GSMNC083

GSMN ID C-No Bio-No BiG-No Neutral formula Charged formulaCharge Mass CAS no Name Model ID

GSMNC0830001 C03557 CPD-1106Null C2H8NO3P Null Null 125.0242 2041-14-7 (2AE)P

(2-Aminoethyl)phosphonate

GSMNC0830002 C00986 CPD-313 Null C3H10N2 Null Null 74.0844 109-76-2 13DAP

1,3-Diaminopropane; Trimethylenediamine; 1,3-Propanediamine; Propane-1,3-diamine

GSMNC0830003 C00236 DPG 13dpg C3H8O10P2 C3H4O10P2 -4 265.9593 38168-82-0 13PDG

3-Phospho-D-glyceroyl phosphate

GSMNC0830004 C06142 BUTANOL Null C4H10O Null Null 74.0732 Null 1-Butanol1BOH

GSMNC0830005 C05125 Null 2ahethmpp C14H23N4O8P2S Null Null 469.0712 Null 2(HE)TPP

2-(alpha-Hydroxyethyl)thiamine diphosphate

GSMNC0830006 C03044 Null

BUTANEDIOL C4H10O2 Null Null 90.0681 24347-58-8 23BOH

(R,R)-Butane-2,3-diol; (R,R)-2,3-Butanediol; (R,R)-2,3-Butylene glycol

GSMNC0830007 C03283 CPD-470 Null C4H10N2O2 Null Null 118.0742 1758-80-1 24DAB

L-2,4-Diaminobutanoate

GSMNC0830008 C02218 Null

2-AMINOACRYLATEC3H5NO2 Null Null 87.032 Null 2AA

2-Aminoacrylate

GSMNC0830009 C04233 Null Null C9H20NO7PR Null Null Null Null 2AG3PC

2-Acyl-sn-glycero-3-phosphocholine

GSMNC0830010 C05973 Null Null C6H13NO7PR Null Null Null Null 2AG3PE

2-Acyl-sn-glycero-3-phosphoethanolamine; L-1-Lysophosphatidylethanolamine

GSMNC0830011 C05974 Null Null C7H13NO9PR Null Null Null Null 2AG3PS

2-Acyl-sn-glycero-3-phosphoserine

GSMNC0830012 C03974 Null Null C4H8O7PR Null Null Null Null 2AGL3P

2-Acyl-sn-glycerol 3-phosphate

GSMNC0830013 C03459 CPD-66 oxglyc C4H4O6 Null Null 148.0008 Null 2H3OSUCC

2-Hydroxy-3-oxosuccinate; Oxaloglycolate

GSMNC0830014 C05805 Null Null C38H56O4 Null Null 576.4179 Null 2HP3M5H6M14B

2-Hexaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinone

GSMNC0830015 C05804 Null

CPD-11656 C38H56O3 Null Null 560.4229 Null 2HP3M6M14B

2-Hexaprenyl-3-methyl-6-methoxy-1,4-benzoquinone

GSMNC0830016 C05852 Null

CPD-11495 C8H8O3 Null Null 152.0473 614-75-5 2HPA

2-Hydroxyphenylacetate

GSMNC0830017 C06452 CPD-9465Null C3H9O4P Null Null 140.0238 Null 2HPP

2-Hydroxypropylphosphonate

GSMNC0830018 C03344 2maacoa C26H42N7O18P3SNull

2-METHYL-ACETO-ACETYL-COA Null 865.152 Null 2MAACCOA

2-Methylacetoacetyl-CoA

GSMNC0830019 C03345 CPD-10832mb2coa C26H42N7O17P3SNull Null 849.1571 Null 2MB2ECOA

2-Methylbut-2-enoyl-CoA

GSMNC0830020 C01033 2mbcoa C26H44N7O17P3SNull

2-METHYL-BUTYRYL-COA Null 851.1727 Null 2MBCOA

(S)-2-Methylbutanoyl-CoA

GSMNC0830021 C02225 CPD-622 2mcit C7H10O7 C7H7O7 -3 206.0427 96-17-3 2MCIT

2-Methylcitrate

GSMNC0830022 C03460 2mp2coa

METHACRYLYL-COA C25H40N7O17P3SNull Null 835.1414 Null 2MP2ECOA

2-Methylprop-2-enoyl-CoA

GSMNC0830023 C00630 ibcoa

ISOBUTYRYL-COA C25H42N7O17P3SNull Null 837.1571 Null 2MPPACOA

2-Methylpropanoyl-CoA

GSMNC0830024 C02116 CPD-244 n2ppn C3H7NO2 Null Null 89.0477 79-46-9 2NPRPN

2-Nitropropane

GSMNC0830025 C00322 Null

2K-ADIPATE C6H8O5 Null Null 160.0372 3184-35-8 2OAD

2-Oxoadipate

GSMNC0830026 C05815 Null C48H72O4

OCTAPRENYL-METHYL-OH-METHOXY-BENZQNull Null 712.5431 Null 2OP3M5H6M14BQ

2-Octaprenyl-3-methyl-5-hydroxy-6-methoxy-1,4-benzoquinone

GSMNC0830027 C05814 Null C48H72O3

OCTAPRENYL-METHYL-METHOXY-BENZQ Null Null 696.5481 Null 2OP3M6M14BQ

2-Octaprenyl-3-methyl-6-methoxy-1,4-benzoquinone

GSMNC0830028 C05811 2ohph C46H70O2

2-OCTAPRENYL-6-HYDROXYPHENOL C46H70O2 0 654.5376 Null 2OP6HP

2-Octaprenyl-6-hydroxyphenol

GSMNC0830029 C05813 Null C47H70O3

OCTAPRENYL-METHOXY-BENZOQUINONE Null Null 682.5325 Null 2OP6M14BQ

2-Octaprenyl-6-methoxy-1,4-benzoquinone

GSMNC0830030 C05812 2omph C47H72O2

2-OCTAPRENYL-6-METHOXYPHENOL C47H72O2 0 668.5532 Null 2OP6MP

2-Octaprenyl-6-methoxyphenol

GSMNC0830031 C05810 2oph

2-OCTAPRENYLPHENOLC46H70O C46H70O 0 638.5427 Null 2OPP

2-Octaprenylphenol

GSMNC0830032 C13309 CPD-6947Null C30H44O2 Null Null 436.3341 Null 2P14NQ

2-Phytyl-1,4-naphthoquinone

GSMNC0830033 C05985 Null Null C3H2O Null Null 54.0106 Null 2P1A

2-Propyn-1-al

GSMNC0830034 C11436 2p4c2me

2-PHOSPHO-4-CYTIDINE-5-DIPHOSPHO-2-C-MET

C14H26N3O17P3 C14H22N3O17P3-4 601.0475 Null 2PCDPMDE

2-Phospho-4-(cytidine 5'-diphospho)-2-C-methyl-D-erythritol

GSMNC0830035 C00631 2-PG 2pg C3H7O7P C3H4O7P -3 185.9929 Null 2PG

2-Phospho-D-glycerate

GSMNC0830036 C00988 CPD-67 2pglyc C2H5O6P C2H2O6P -3 155.9824 Null 2PPG

2-Phosphoglycolate

GSMNC0830037 C00230 34dhbz C7H6O4

3-4-DIHYDROXYBENZOATE Null Null 154.0266 99-50-3 34DHB

3,4-Dihydroxybenzoate; 3,4-Dihydroxybenzoic acid;; Protocatechuate; Protocatechuic acid

GSMNC0830038 C05577 Null C8H8O4

DIHYDROXYPHENYLGLYCOLALDEHYDE Null Null 168.0423 Null 34DHMA

3,4-Dihydroxymandelaldehyde

GSMNC0830039 C01161 CPD-782 34dhpha C8H8O4 C8H7O4 -1 168.0423 102-32-9 34DHPA

3,4-Dihydroxyphenylacetate

GSMNC0830040 C05576 Null

CPD-11878 C8H10O4 Null Null 170.0579 Null 34DHPEG

3,4-Dihydroxyphenylethyleneglycol

GSMNC0830041 C11638 Null C3H8NO5P

1-AMINO-PROPAN-2-ONE-3-PHOSPHATE Null Null 169.014 Null 3A2OP

3-Amino-2-oxopropyl phosphate

GSMNC0830042 C05665 CPD-6082Null C3H7NO Null Null 73.0528 Null 3AP

3-Aminopropanal; beta-Aminopropion aldehyde

GSMNC0830043 C06145 Null Null C4H4O Null Null 68.0262 52844-23-2 3B1A

3-Butyn-1-al

GSMNC0830044 C06144 Null Null C4H4O2 Null Null 84.0211 2345-51-9 3BUT

3-Butynoate

GSMNC0830045 C04691 2dda7p C7H13O10P

3-DEOXY-D-ARABINO-HEPTULOSONATE-7-P

C7H10O10P -3 288.0246 2627-73-8 3DDAH7P

2-Dehydro-3-deoxy-D-arabino-heptonate 7-phosphate

GSMNC0830046 C04405 3hmbcoa C26H44N7O18P3SNull

2-METHYL-3-HYDROXY-BUTYRYL-COA Null 867.1676 Null 3H2MBCOA

(2S,3S)-3-Hydroxy-2-methylbutanoyl-CoA

GSMNC0830047 C00356 hmgcoa C27H44N7O20P3SNull

3-HYDROXY-3-METHYL-GLUTARYL-COA Null 911.1575 1553-55-5 3H3MGCOA

(S)-3-Hydroxy-3-methylglutaryl-CoA

GSMNC0830048 C00632 Null C7H7NO3

3-HYDROXY-ANTHRANILATE Null Null 153.0426 548-93-6 3HAN

3-Hydroxyanthranilate

GSMNC0830049 C04593 CPD-618 micit C7H10O7 C7H7O7 -3 206.0427 20298-95-7 3HB123TC

(2S,3R)-3-Hydroxybutane-1,2,3-tricarboxylate

GSMNC0830050 C01144 3hbcoa;3hbycoa

S-3-HYDROXYBUTANOYL-COA

C25H42N7O18P3SC25H38N7O18P3S

-4 853.152 Null 3HBCOA

(S)-3-Hydroxybutanoyl-CoA

GSMNC0830051 C01089 CPD-335 3hbut-R C4H8O3 Null Null 104.0473 Null 3HBUT

(R)-3-Hydroxybutanoate; (R)-3-Hydroxybutyric acid

GSMNC0830052 C06000 Null Null C25H42N7O18P3SNull Null 853.152 Null 3HIBCOA

(S)-3-Hydroxyisobutyryl-CoA

GSMNC0830053 C05998 Null Null C26H44N7O18P3SNull Null 867.1676 Null 3HIVCOA

3-Hydroxyisovaleryl-CoA

GSMNC0830054 C05593 Null Null C8H8O3 Null Null 152.0473 621-37-4 3HPA

3-Hydroxyphenylacetate

GSMNC0830055 C05668 Null C24H40N7O18P3SNull

3-HYDROXY-PROPIONYL-COA Null 839.1363 Null 3HPCOA

3-Hydroxypropionyl-CoA

GSMNC0830056 C02939 ivcoa

ISOVALERYL-COA C26H44N7O17P3SNull Null 851.1727 Null 3MBCOA

3-Methylbutanoyl-CoA

GSMNC0830057 C03069 3mb2coa C26H42N7O17P3SNull

3-METHYL-CROTONYL-COA Null 849.1571 Null 3MCCOA

3-Methylcrotonyl-CoA

GSMNC0830058 C03231 Null C27H42N7O19P3SNull

TRANS-3-METHYL-GLUTACONYL-COA Null 893.1469 Null 3MGCOA

3-Methylglutaconyl-CoA

GSMNC0830059 C00671 3mop C6H10O3

2-KETO-3-METHYL-VALERATE C6H9O3 -1 130.063 Null 3MOP

(S)-3-Methyl-2-oxopentanoic acid; (S)-3-Methyl-2-oxopentanoate; (3S)-3-Methyl-2-oxopentanoic acid; (3S)-3-M

GSMNC0830060 C05809 3ophb C47H70O3

3-OCTAPRENYL-4-HYDROXYBENZOATE C47H69O3 -1 682.5325 Null 3OP4HB

3-Octaprenyl-4-hydroxybenzoate

GSMNC0830061 C00222 msa

MALONATE-S-ALD C3H4O3 C3H3O3 -1 88.016 Null 3OPP

3-Oxopropanoate; Malonate semialdehyde

GSMNC0830062 C00197 G3P 3pg C3H7O7P C3H4O7P -3 185.9929 Null 3PG

3-Phospho-D-glycerate

GSMNC0830063 C01005 pser-L

3-P-SERINE C3H8NO6P C3H6NO6P -2 185.0089 407-41-0 3PSER

3-Phosphoserine

GSMNC0830064 C01269 3psme C10H13O10P

3-ENOLPYRUVYL-SHIKIMATE-5P C10H9O10P -4 324.0246 Null 3PSME

5-O-(1-Carboxyvinyl)-3-phosphoshikimate

GSMNC0830065 C05527 3snpyr

3-SULFINYL-PYRUVATE C3H4O5S C3H2O5S -2 151.9779 28954-12-3 3SFPYR

3-Sulfinylpyruvate

GSMNC0830066 C00606 3sala

3-SULFINOALANINEC3H7NO4S C3H5NO4S -2 153.0096 1115-65-7 3SLALA

3-Sulfino-L-alanine

GSMNC0830067 C05528 CPD-380 3spyr C3H4O6S C3H2O6S -2 167.9729 Null 3SPYR

3-Sulfopyruvate

GSMNC0830068 C02946 CPD-35 Null C6H11NO3 Null Null 145.0739 Null 4AABUT

4-Acetamidobutanoate

GSMNC0830069 C00555 4abutn C4H9NO

4-AMINO-BUTYRALDEHYDE C4H10NO 1 87.0684 Null 4AB

4-Aminobutanal

GSMNC0830070 C01061 Null C8H8O6

4-FUMARYL-ACETOACETATE Null Null 200.0321 28613-33-4 4FAAC

4-Fumarylacetoacetate

GSMNC0830071 C03078 Null

4-GUANIDO-BUTYRAMIDEC5H12N4O Null Null 144.1011 Null 4GBTA

4-Guanidinobutanamide

GSMNC0830072 C01035 CPD-592 Null C5H11N3O2 Null Null 145.0851 Null 4GBTR

4-Guanidinobutanoate; 4-Guanidinobutyric acid

GSMNC0830073 C00156 4hbz

4-hydroxybenzoate C7H6O3 C7H5O3 -1 138.0317 99-96-7 4HB

4-Hydroxybenzoate

GSMNC0830074 C05938 Null C5H9NO4

L-4-HYDROXYGLUTAMATE_SEMIALDEHYDE Null Null 147.0532 Null 4HGLUSA

L-4-Hydroxyglutamate semialdehyde

GSMNC0830075 C06056 CPD0-21894hthr C4H9NO4 C4H9NO4 0 135.0532 Null 4HLT

4-Hydroxy-L-threonine

GSMNC0830076 C00650 Null Null C8H7NO2 Null Null 149.0477 Null 4HMN

4-Hydroxymandelonitrile

GSMNC0830077 C00642 4hphac C8H8O3

4-HYDROXYPHENYLACETATE C8H7O3 -1 152.0473 156-38-7 4HPA

4-Hydroxyphenylacetate

GSMNC0830078 C03765 4hoxpacd C8H8O2

HYDRPHENYLAC-CPD C8H8O2 0 136.0524 7339-87-9 4HPACAL

4-Hydroxyphenylacetaldehyde; 2-(4-Hydroxyphenyl)acetaldehyde

GSMNC0830079 C04353 CPD-1041 Null C8H9NO2 Null Null 151.0633 Null 4HPACALO

(Z)-4-Hydroxyphenylacetaldehyde-oxime

GSMNC0830080 C05338 Null hphaccoa C29H42N7O18P3SNull Null 901.152 Null 4HPACOA

4-Hydroxyphenylacetyl-CoA

GSMNC0830081 C05596 Null Null C10H11NO4 Null Null 209.0688 Null 4HPAGLY

4-Hydroxyphenylacetylglycine

GSMNC0830082 C01179 34hpp C9H8O4

P-HYDROXY-PHENYLPYRUVATE C9H7O4 -1 180.0423 156-39-8 4HPP

3-(4-Hydroxyphenyl)pyruvate

GSMNC0830083 C01157 Null 4hpro-LT C5H9NO3 C5H9NO3 0 131.0582 51-35-4 4HPRO

trans-4-Hydroxy-L-proline

GSMNC0830084 C03680 Null C6H8N2O3

4-IMIDAZOLONE-5-PROPIONATE Null Null 156.0535 Null 4I5P

4-Imidazolone-5-propanoate

GSMNC0830085 C01036 Null C8H8O6

4-MALEYL-ACETOACETATE Null Null 200.0321 5698-52-2 4MAAC

4-Maleylacetoacetate

GSMNC0830086 C00233 4mop

2K-4CH3-PENTANOATE C6H10O3 C6H9O3 -1 4MOP

130.063 816-66-0 4-Methyl-2-oxopentanoate

GSMNC0830087 C04352 4ppcys C12H23N2O9PS C12H20N2O9PS -3

R-4-PHOSPHOPANTOTHENOYL-L-CYSTEINE 402.0862 Null 4PPNCYS

(R)-4'-Phosphopantothenoyl-L-cysteine

GSMNC0830088 C01134 pan4p

PANTETHEINE-P C11H23N2O7PS C11H21N2O7PS -2 358.0964 Null 4PPNTE

Pantetheine 4'-phosphate

GSMNC0830089 C03492 4ppan

4-P-PANTOTHENATE C9H18NO8P C9H15NO8P -3 299.077 Null 4PPNTO

D-4'-Phosphopantothenate

GSMNC0830090 C01149 Null

4-TRIMETHYLAMMONIOBUTANAL Null

C7H16NO Null 130.1232 Null 4TMABT

4-Trimethylammoniobutanal

GSMNC0830091 C01181 Null

GAMMA-BUTYROBETAINE C7H16NO2 Null Null 146.1181 Null 4TMABTO

4-Trimethylammoniobutanoate

GSMNC0830092 C05516 Null C4H5N3O2

4-AMINO-5-IMIDAZOLE_CARBOXYLATE Null Null 127.0382 Null 5A4ICA

5-Amino-4-imidazole carboxylate

GSMNC0830093 C05239 Null

AMINO-IMIDAZOLE C3H5N3 Null Null 5AI

83.0483 4919-3-3 5-Aminoimidazole; Aminoimidazole; 4-Aminoimidazole

GSMNC0830094 C04052 CPD-785 5c2oh3e C8H8O7 C8H5O7 -3 216.027 Null 5C2O3E

5-Carboxy-2-oxohept-3-enedioate

GSMNC0830095 C04186 CPD-784 5cm2hm C8H8O7 C8H5O7 -3 216.027 Null 5CM2HM

5-Carboxymethyl-2-hydroxymuconate

GSMNC0830096 C03193 Null Null C7H11N2O5R(C2H2NOR)n

Null Null Null Null 5GLUPEPT

(5-L-Glutamyl)-peptide

GSMNC0830097 C05634 Null C10H9NO2

5-HYDROXYINDOLE_ACETALDEHYDE Null Null 175.0633 Null 5HIAA

5-Hydroxyindoleacetaldehyde

GSMNC0830098 C05635 Null C10H9NO3

5-HYDROXYINDOLE_ACETATE Null Null 191.0582 Null 5HIAC

5-Hydroxyindoleacetate

GSMNC0830099 C02967 Null 5mcsn C10H16N3O7P(C5H8O5PR)n(C5H8O5PR)n Null

Null Null Null 5MC

DNA 5-methylcytosine; DNA containing 5-methylcytosine; 5-Methylcytosine (in DNA)

GSMNC0830100 C03089 CPD-560 5mtr C6H12O4S C6H12O4S 0 180.0456 Null 5MDR

5-Methylthio-D-ribose

GSMNC0830101 C00170 5mta C11H15N5O3S C11H15N5O3S 0

5-METHYLTHIOADENOSINE 5MTA

297.0896 2457-80-9 5'-Methylthioadenosine

GSMNC0830102 C04489 CPD-13025mthglu C30H39N9O12 C25H34N8O12 -2 717.2718 Null 5MTGLU

5-Methyltetrahydropteroyltri-L-glutamate

GSMNC0830103 C06249 Null Null C7H13N3O2R2 Null Null Null Null A[C]

Apo-[carboxylase]

GSMNC0830104 C01112 ara5p

ARABINOSE-5P C5H11O8P C5H9O8P -2 230.0192 Null A5P

D-Arabinose 5-phosphate

GSMNC0830105 C04732 4r5au C9H16N4O6

AMINO-RIBOSYLAMINO-1H-3H-PYR-DIONEC9H16N4O6 0 276.107 Null A6RP

5-Amino-6-ribitylamino-2,4 (1H, 3H)-pyrimidinedione; 4-(1-D-Ribitylamino)-5-amino-2,6-dihydroxypyrimidine;

GSMNC0830106 C01268 CPD-602 5apru C9H15N4O9P C9H13N4O9P -2 354.0577 Null A6RP5P

5-Amino-6-(5'-phosphoribosylamino)uracil

GSMNC0830107 C04454 CPD-10865aprbu C9H17N4O9P C9H15N4O9P -2 356.0733 Null A6RP5P2

5-Amino-6-(5'-phosphoribitylamino)uracil

GSMNC0830108 C06735 CPD-1772aacald C2H5NO C2H6NO 1 AAA

59.0371 452-86-8 Aminoacetaldehyde

GSMNC0830109 C00164 acac

3-KETOBUTYRATE C4H6O3 C4H5O3 -1 AAC

102.0317 541-50-4 Acetoacetate

GSMNC0830110 C00332 aacoa

ACETOACETYL-COA -4

C25H40N7O18P3SC25H36N7O18P3S AACCOA

851.1363 1420-36-6 Acetoacetyl-CoA

GSMNC0830111 C01888 aact

AMINO-ACETONE C3H7NO C3H8NO 1 AACTN

73.0528 298-08-8 Aminoacetone; 1-Amino-2-propanone

GSMNC0830112 C05993 Null

ACETYL_AMP C12H16N5O8P Null Null 389.0736 Null AAD

Acetyl adenylate

GSMNC0830113 C06006 2ahbut

2-ACETO-2-HYDROXY-BUTYRATE C6H9O4

C6H10O4 -1 146.0579 Null ABUT

(S)-2-Aceto-2-hydroxybutanoate

GSMNC0830114 C00033 ACET ac C2H4O2 C2H3O2 -1 Acetate AC

60.0211 64-19-7;71-50-1

GSMNC0830115 C03939 Null acACP C2H3OSR C13H23N2O8PRS-1 Null Null ACACP

Acetyl-[acyl-carrier protein]

GSMNC0830116 C00084 ACETALD acald C2H4O C2H4O 0 44.0262 75-07-0 ACAL

Acetaldehyde

GSMNC0830117 C00024 accoa

ACETYL-COA C23H38N7O17P3SC23H34N7O17P3S

-4 809.1258 72-89-9 ACCOA

Acetyl-CoA

GSMNC0830118 C06506 Null adcobdam C55H73CoN11O15 C55H68CoN11O15

-4 1186.462 Null ACDA

Adenosyl cobyrinate a,c diamide

GSMNC0830119 C00227 ACETYL-Pactp C2H5O5P C2H3O5P -2 ACETYLP

139.9875 19926-71-7 Acetyl phosphate

GSMNC0830120 C00900 Null Null C5H8O4 Null Null 132.0423 Null ACLAC

2-Acetolactate

GSMNC0830121 C00040 Null Null C22H35N7O17P3SR

Null Null Null A

9029-97-4 Acyl-CoA COA

GSMNC0830122 C00229 Null ACP HSR C11H21N2O7PRS-1 Null Null ACP

Acyl-carrier protein

GSMNC0830123 C00810 Null

CPD-10353 C4H8O2 Null Null ACT

88.0524 513-86-0 (R)-Acetoin; (R)-2-Acetoin; (R)-3-Hydroxy-2-butanone; (R)-Dimethylketol; (R)-3-Hydroxybutan-2-one

GSMNC0830124 C00207 ACETONE acetone C3H6O Null Null 58.0419 67-64-1 Dimethyl ketone; 2-Propanone

Acetone;ACTN

GSMNC0830125 C00147 ADENINE ade C5H5N5 C5H5N5 0 135.0545 73-24-5 Adenine AD

GSMNC0830126 C06508 adcoba;adocbi

ADENOSYLCOBINAMIDE C58H84CoN16O11C58H84CoN16O11

1 1239.5837 Null ADCBA

Adenosyl cobinamide

GSMNC0830127 C06509 adcobap;adocbip

ADENOSYLCOBINAMIDE-PC58H85CoN16O14P

C58H83CoN16O14P

-1 1319.5501 Null ADCBAP

Adenosyl cobinamide phosphate

GSMNC0830128 C11355 4adcho C10H11NO5

4-AMINO-4-DEOXYCHORISMATE C10H10NO5 -1 225.0637 Null ADCHOR

4-amino-4-deoxychorismate

GSMNC0830129 C01136 adhlam

S-ACETYLDIHYDROLIPOAMIDE

C10H19NO2S2 Null Null 249.0857 Null ADLIPO

6-S-Acetyldihydrolipoamide; [Dihydrolipoyllysine-residue acetyltransferase] Sacetyldihydrolipoyllysine; S-Acety

GSMNC0830130 C00212 adn

ADENOSINE C10H13N5O4 C10H13N5O4 0 267.0968 58-61-7 ADN

Adenosine

GSMNC0830131 C00008 ADP adp C10H15N5O10P2 C10H12N5O10P2-3 ADP

427.0294 20398-34-9;58-64-0 ADP

GSMNC0830132 C00780 Null

SEROTONIN C10H12N2O Null Null 176.095 50-67-9 AEIOH

3-(2-Aminoethyl)-1H-indol-5-ol; Serotonin; 5-Hydroxytryptamine; Enteramine

GSMNC0830133 C00826 CPD-659 Largn C10H13NO5 C10H13NO5 0 AG

227.0794 53078-86-7 L-Arogenate

GSMNC0830134 C06510 adgcoba;agdpcbi

ADENOSYLCOBINAMIDE-GDP

C68H97CoN21O21P2

C68H95CoN21O21P2

-1 1664.5975 Null AGDPCBA

Adenosine-GDP-cobinamide

GSMNC0830135 C15590 Null Null Null Null Null Null Null AGL

Acylglycerol

GSMNC0830136 C00681 Null 1ag3p C4H8O7PR Null Null Null Null AGL3P

1-Acyl-sn-glycerol 3-phosphate

GSMNC0830137 C04807 2ahhmd C7H11N5O8P2 C7H8N5O8P2 -3

DIHYDROPTERIN-CH2OH-PP AHHMD

355.0083 70608-72-9 2-Amino-7,8-dihydro-4-hydroxy-6-(diphosphooxymethyl)pteridine

GSMNC0830138 C01300 Null 2ahhmp C7H9N5O2 C7H9N5O2 0 195.0756 Null AHHMP

2-Amino-4-hydroxy-6-hydroxymethyl-7,8-dihydropteridine

GSMNC0830139 C01279 HMP 4ahmmp C6H9N3O C6H9N3O 0 139.0746 73-67-6 AHM

4-Amino-5-hydroxymethyl-2-methylpyrimidine

GSMNC0830140 C04556 4ampm C6H10N3O4P

AMINO-HYDROXYMETHYL-METHYL-PYR-P C6H8N3O4P -2 219.0409 Null AHMP

4-Amino-5-hydroxymethyl-2-methylpyrimidine-phosphate

GSMNC0830141 C04752 2mahmp C6H11N3O7P2 C6H8N3O7P2 -3

AMINO-HYDROXYMETHYL-METHYLPYRIMIDINE-PP AHMPP

299.0072 745-65-3 4-Amino-5-hydroxymethyl-2-methylpyrimidine-pyrophosphate

GSMNC0830142 C04895 ahdt C9H16N5O13P3 C9H12N5O13P3 -4

2-AMINO-ETCETERA-TRIPHOSPHATE;DIHYDRONEOPTERIN-P3 494.9957 Null AHTD

2-Amino-4-hydroxy-6-(erythro-1,2,3-trihydroxypropyl)dihydropteridine triphosphate; 6-(Lerythro-1,2-Dihydroxy

GSMNC0830143 C03284 CPD-466 Null C4H9NO2 Null Null 103.0633 Null AIBUT

L-3-Amino-isobutanoate; (S)-3-Amino-isobutyrate; L-3-Amino-isobutyrate; (S)-3-Aminoisobutanoate; (S)-3-Am

GSMNC0830144 C04677 AICAR aicar C9H15N4O8P C9H13N4O8P -2 AICAR

338.0628 3031-94-5 1-(5'-Phosphoribosyl)-5-amino-4-imidazolecarboxamide

GSMNC0830145 C03373 air C8H14N3O7P

5-PHOSPHORIBOSYL-5-AMINOIMIDAZOLE C8H12N3O7P -2 AIR

295.0569 25635-88-5 Aminoimidazole ribotide

GSMNC0830146 C00026 akg

2-KETOGLUTARATEC5H6O5 C5H4O5 -2 AKG

146.0215 328-50-7 2-Oxoglutarate

GSMNC0830147 C00041 ala-L

L-ALPHA-ALANINE C3H7NO2 C3H7NO2 0 89.0477 56-41-7 ALA

L-Alanine

GSMNC0830148 C00993 alaala

D-ALA-D-ALA C6H12N2O3 C6H12N2O3 0 ALAALA

160.0848 923-16-0 D-alanyl-D-alanine

GSMNC0830149 C00886 Null alatrna C13H22NO11PR2(C5H8O6PR)n 1

C3H6NOR Null Null ALATRNA

L-Alanyl-tRNA

GSMNC0830150 C00430 5aop

5-AMINO-LEVULINATE C5H9NO3 C5H9NO3 0 ALAV

131.0582 106-60-5 D-Aminolevulinate

GSMNC0830151 C00499 alltt

ALLANTOATE C4H8N4O4 C4H7N4O4 -1 176.0546 99-16-1 ALLNT

Allantoate; Allantoic acid

GSMNC0830152 C00020 AMP amp C10H14N5O7P C10H12N5O7P -2 347.0631 61-19-8 AMP AMP

GSMNC0830153 C00108 anth

ANTHRANILATE C7H7NO2 C7H6NO2 -1 AN

137.0477 118-92-3 Anthranilate

GSMNC0830154 C01092 8aonn C9H17NO3

8-AMINO-7-OXONONANOATE C9H17NO3 0 187.1208 Null AONA

8-amino-7-oxononanoate

GSMNC0830155 C05670 Null

BETA-AMINOPROPIONITRILE

C3H6N2 Null Null APN

70.0531 151-18-8 beta-Aminopropionitrile; 3-Aminopropiononitrile

GSMNC0830156 C01260 ap4a

ADENOSYL-P4 C20H28N10O19P4C20H24N10O19P4

-4 836.0483 Null AppppA

P1,P4-Bis(5'-adenosyl) tetraphosphate

GSMNC0830157 C00224 APS aps C10H14N5O10PS C10H12N5O10PS-2 APS

427.0199 485-84-7 Adenylylsulfate; Adenylyl sulfate; Adenosine 5'-phosphosulfate; APS; 5'-Adenylyl sulfate

GSMNC0830158 C05775 rdmbzi

ALPHA-RIBAZOLE C14H18N2O4 C14H18N2O4 0 ARBZ

278.1267 132-13-8 alpha-Ribazole; N1-(alpha-D-ribosyl)-5,6-dimethylbenzimidazole

GSMNC0830159 C00062 ARG arg-L C6H14N4O2 C6H15N4O2 1 174.1117 74-79-3 ARG

L-Arginine

GSMNC0830160 C03406 argsuc

L-ARGININO-SUCCINATE C10H18N4O6 C10H17N4O6 -1 ARGSUCC

290.1226 2387-71-5 N-(L-Arginino)succinate

GSMNC0830161 C02163 Null argtrna C21H33N9O11PR(C5H8O6PR)n 2

C6H14N4OR Null Null ARGTRNAARG

L-Arginyl-tRNA(Arg)

GSMNC0830162 C00301 adprib C15H23N5O14P2

ADENOSINE_DIPHOSPHATE_RIBOSE C15H21N5O14P2-2 559.0717 Null ARIB

ADPribose

GSMNC0830163 C05686 Null Null C10H14N5O10PSeNull Null 474.9644 Null ASELNT

Adenylylselenate

GSMNC0830164 C00979 acser

ACETYLSERINE C5H9NO4 C5H9NO4 0 O-Acetyl-L-serine

ASER

147.0532 5147-00-2;66638-22-0

GSMNC0830165 C00152 ASN asn-L C4H8N2O3 C4H8N2O3 0 132.0535 70-47-3 ASN

L-Asparagine

GSMNC0830166 C03402 Null asntrna C14H23N2O12PR2(C5H8O6PR)n 1

C14H23N2O12PR2 Null Null ASNTRNAASN

L-Asparaginyl-tRNA(Asn)

GSMNC0830167 C00049 asp-L

L-ASPARTATE C4H7NO4 C4H6NO4 -1 133.0375 56-84-8 ASP

L-Aspartate

GSMNC0830168 C00441 aspsa C4H7NO3

L-ASPARTATE-SEMIALDEHYDE C4H7NO3 0 117.0426 Null ASPSA

L-Aspartate 4-semialdehyde

GSMNC0830169 C06113 Null asptrna(asn) C14H22NO13PR2(C5H8O6PR)n 0

C14H22NO13PR2 Null Null ASPTRNAASN

L-Aspartyl-tRNA(Asn)

GSMNC0830170 C02984 Null asptrna C14H22NO13PR2(C5H8O6PR)n 0

C4H5NO3R Null Null ASPTRNAASP

L-Aspartyl-tRNA(Asp)

GSMNC0830171 C03794 dcamp

ADENYLOSUCC C14H18N5O11P C14H14N5O11P -4 ASUC

463.074 19046-78-7 N6-(1,2-Dicarboxyethyl)-AMP

GSMNC0830172 C00002 ATP atp C10H16N5O13P3 C10H12N5O13P3-4 506.9957 56-65-5 ATP ATP

GSMNC0830173 btamp

C05921 BIO-5-AMP C20H28N7O9PS C20H27N7O9PS -1 573.1407 Null B5AMP

Biotinyl-5'-AMP

GSMNC0830174 Null

C00576 BETAINE_ALDEHYDE C5H12NO Null Null 102.0919 Null BAL

Betaine aldehyde

GSMNC0830175 ala-B

C00099 B-ALANINE C3H7NO2 C3H7NO2 0 89.0477 107-95-9 bALA

beta-Alanine

GSMNC0830176 C05665 CPD-6082Null C3H7NO Null Null 73.0528 Null bAPA

beta-Aminopropion aldehyde

GSMNC0830177 4pasp

C03082 L-BETA-ASPARTYL-P C4H8NO7P C4H6NO7P -2 213.0038 Null BASP

4-Phospho-L-aspartate

GSMNC0830178 C01172 GLC-6-P g6p-B C6H13O9P Null Null 260.0297 Null bDG6P

beta-D-Glucose 6-phosphate

GSMNC0830179 C00221 GLC C6H12O6

b-D-glucose;glc-B C6H12O6 0 180.0634 492-61-5 bDGLC

beta-D-Glucose

GSMNC0830180 C00719 BETAINE glyb C5H11NO2 C5H11NO2 0 117.079 107-43-7 Glycine betaine

Betaine; BETAINE

GSMNC0830181 Biomass Null Null Null Null Null Null Null BIOMASS

Cell biomass

GSMNC0830182 C00120 BIOTIN btn C10H16N2O3S C10H15N2O3S -1 244.0882 58-85-5 Biotin BT

GSMNC0830183 C01412 BUTANAL btal C4H8O C4H8O 0 72.0575 123-72-8 Butanal BUTANAL

GSMNC0830184 C00180 BENZOATEbz C7H6O2 Null Null 122.0368 65-85-0 BZ

Benzoate; Benzoic acid; Benzenecarboxylic acid; Phenylformic acid; Dracylic acid

GSMNC0830185 cbl1

C00853 COB-I-ALAMIN C62H89CoN13O14P

C62H88CoN13O14P

-1 1329.5722 18534-66-2 C(I)A

Cob(I)alamin; Cbl; Vitamin B12s

GSMNC0830186 C06505 Null co1dam C45H61CoN6O12 C45H56CoN6O12-5 936.3679 Null C(I)DA

Cob(I)yrinate a,c diamide

GSMNC0830187 Null Null Null Null Null Null Null Null C090ACP

Nonanoyl-[acyl-carrier protein]

GSMNC0830188 C01571 CPD-3617dca C10H20O2 C10H19O2 -1 172.1463 334-48-5 C100

Decanoic acid

GSMNC0830189 C05755 Null dcaACP C10H19OSR C21H39N2O8PRS-1 Null Null C100ACP

Decanoyl-[acyl-carrier protein]

GSMNC0830190 Null Null Null Null Null Null Null Null C110ACP

Undecanoyl-[acyl-carrier protein]

GSMNC0830191 ddca

C02679 DODECANOATE C12H24O2 C12H23O2 -1 200.1776 143-07-7 C120

Dodecanoic acid

GSMNC0830192 C05223 Null ddcaACP C12H23OSR C23H43N2O8PRS-1 Null Null C120ACP

Dodecanoyl-[acyl-carrier protein]

GSMNC0830193 Null Null Null Null Null Null Null Null C120OH

beta-hydroxy dodecanoic acid

GSMNC0830194 C05280 Null Null C33H54N7O17P3SNull Null 945.251 Null C121COA

cis,cis-3,6-Dodecadienoyl-CoA

GSMNC0830195 C05279 Null Null C33H54N7O17P3SNull Null 945.251 Null C122COA

trans,cis-Lauro-2,6-dienoyl-CoA

GSMNC0830196 Null Null Null Null Null Null Null Null C130ACP

Tridecanoyl-[acyl-carrier protein]

GSMNC0830197 C06424 CPD-7836ttdca;ttdcea C14H28O2 C14H27O2 -1 228.2089 544-63-8 C140

Tetradecanoic acid

GSMNC0830198 C05761 Null myrsACP C14H27OSR C25H47N2O8PRS-1 Null Null C140ACP

Tetradecanoyl-[acyl-carrier protein]

GSMNC0830199 Null Null Null Null Null Null Null Null C140OH

beta-hydroxy tetradecanoic acid

GSMNC0830200 C16537 Null Null C15H30O2 Null Null 242.2246 Null C150

Pentadecanoic acid

GSMNC0830201 Null Null Null Null Null Null Null Null C150ACP

Pentadecanoyl-[acyl-carrier protein]

GSMNC0830202 Null Null Null Null Null Null Null Null C151ACP

Pentadecenoyl-[acyl-carrier protein]

GSMNC0830203 hdca

C00249 PALMITATE C16H32O2 C16H31O2 -1 256.2402 57-10-3 C160

Hexadecanoic acid

GSMNC0830204 Null

C05764[m] palmACP[m]C16H31OSR C27H51N2O8PRS-1 Null Null C160ACP

Hexadecanoyl-[acyl-carrier protein]

GSMNC0830205 C08362 Null hdcea C16H30O2 C16H29O2 -1 254.2246 373-49-9 C161

Hexadecenoic acid

GSMNC0830206 C04364 Null hdeACP Null Null Null Null Null C161ACP

Hexadecenoyl-[acyl-carrier protein]

GSMNC0830207 C16536 Null Null C17H32O2 Null Null 268.2402 Null C170

Heptadecanoic acid

GSMNC0830208 C12349 Null Null C17H19O8SR Null Null Null Null C170ACP

Heptadecanoyl-[acyl-carrier protein]

GSMNC0830209 C16536 Null Null C17H32O2 Null Null 268.2402 Null C171

Heptadecenoic acid

GSMNC0830210 C12349 Null Null C17H19O8SR Null Null Null Null C171ACP

Heptadecenoyl-[acyl-carrier protein]

GSMNC0830211 ocdca

C01530 STEARIC_ACID C18H36O2 C18H35O2 -1 284.2715 57-11-4 C180

Octadecanoic acid

GSMNC0830212 C04088 Null ocdcaACP C18H35OSR C29H55N2O8PRS-1 Null Null C180ACP

Octadecanoyl-[acyl-carrier protein]

GSMNC0830213 Null Null ocdcea Null Null Null Null Null C181

Octadecenoic acid

GSMNC0830214 C01203 Null octeACP C18H33OSR C29H53N2O8PRS-1 Null Null C181ACP

Octadecenoyl-[acyl-carrier protein]

GSMNC0830215 Null Null Null Null Null Null Null Null C190ACP

Nonadecanoyl-[acyl-carrier protein]

GSMNC0830216 Null Null Null Null Null Null Null Null C191ACP

Nonadecenoyl-[acyl-carrier protein]

GSMNC0830217 Null Null Null Null Null Null Null Null C200ACP

Eicosanoyl-[acyl-carrier protein]

GSMNC0830218 C00438 cbasp

CARBAMYUL-L-ASPARTATEC5H8N2O5 C5H6N2O5 -2 176.0433 Null CAASP

N-Carbamoyl-L-aspartate

GSMNC0830219 C04751 5aizc

PHOSPHORIBOSYL-CARBOXY-AMINOIMIDAZOLE -3

C9H14N3O9P C9H11N3O9P 339.0468 Null CAIR

1-(5-Phospho-D-ribosyl)-5-amino-4-imidazolecarboxylate

GSMNC0830220 C02512 CPD-603 Null C4H6N2O2 Null Null CALA

114.0429 6232-19-5 3-Cyano-L-alanine; L-3-Cyanoalanine; L-beta-Cyanoalanine

GSMNC0830221 C00169 cbp

CARBAMOYL-P CH4NO5P CH2NO5P -2 140.9827 Null CAP

Carbamoyl phosphate

GSMNC0830222 C00090 CATECHOLNull C6H6O2 Null Null CATECHOL

110.0368 120-80-9 Catechol; 1,2-Benzenediol; o-Benzenediol; 1,2-Dihydroxybenzene; Brenzcatechin; Pyrocatechol

GSMNC0830223 Null Null Null Null Null Null Null Null CAV

Cofactors and vitamins

GSMNC0830224 C05774 cbi

COBINAMIDE C48H72CoN11O8 C48H72CoN11O80 Cobinamide

989.4897 13497-85-3;1867-62-5 CBA

GSMNC0830225 C00194 ADENOSYLCOBALAMIN

adocbl;cobamcoa

C72H100CoN18O17P

C72H100CoN18O17P

0 CBCO

1578.6583 13870-90-1 Cobamide coenzyme

GSMNC0830226 C04411 3c2hmp

2-D-THREO-HYDROXY-3-CARBOXY-ISOCAPROATE -2

C7H12O5 C7H10O5 176.0685 Null CBHCAP

3-Isopropylmalate

GSMNC0830227 C00877 b2coa

CROTONYL-COA C25H40N7O17P3SC25H36N7O17P3S -4 Crotonoyl-CoA

835.1414 102680-35-3;992-67-6 CCOA

GSMNC0830228 C05604 CPD-8652Null C9H9NO4 Null Null CDHDHI

195.0532 18766-67-1 2-Carboxy-2,3-dihydro-5,6-dihydroxyindole

GSMNC0830229 C00112 CDP cdp C9H15N3O11P2 C9H12N3O11P2 -3 403.0182 63-38-7 CDP CDP

GSMNC0830230 C00269 Null cdpdag;cdpdhdecg

C14H19N3O15P2R2

C44H79N3O15P2-2 Null Null CDPDG

CDP-diacylglycerol

GSMNC0830231 C11435 4c2me C14H25N3O14P2 C14H23N3O14P2-2

4-CYTIDINE-5-DIPHOSPHO-2-C 521.0812 Null CDPMDE

4-(Cytidine 5'-diphospho)-2-C-methyl-D-erythritol

GSMNC0830232 C00226 Null Null CH3OR Null Null Null Null CH3OR

Primary alcohol

GSMNC0830233 C01063 CPD-558 pmcoa -5

C28H46N7O19P3SC28H41N7O19P3S 909.1782 Null CHCOA

6-carboxyhexanoyl-CoA; Pimeloyl-CoA

GSMNC0830234 C01674 chitob;chtbs;ctobiose

CHITOBIOSE C16H28N2O11 C16H28N2O11 0 424.1693 35061-50-8 ChitobioseCHITB

GSMNC0830235 C00114 CHOLINE chol C5H14NO C5H14NO 1 Choline

104.1075 123-41-1;62-49-7 CHOLINE

GSMNC0830236 C00588 Null

PHOSPHORYL-CHOLINE C5H15NO4P Null Null CHOLINEP

184.0739 107-73-3 Choline phosphate; Phosphorylcholine; Phosphocholine; O-Phosphocholine

GSMNC0830237 C00251 chor

CHORISMATE C10H10O6 C10H8O6 -2 Chorismate

226.0477 55508-12-8;617-12-9CHOR

GSMNC0830238 C00158 CIT cit C6H8O7 C6H5O7 -3 192.027 77-92-9 Citrate CIT

GSMNC0830239 C00327 citr-L

L-CITRULLINE C6H13N3O3 C6H13N3O3 0 175.0957 372-75-8 L-CitrullineCITR

GSMNC0830240 C05980 cdlp

CARDIOLIPIN C13H18O17P2R4 Null Null Null Null CL

Cardiolipin (biomass component)

GSMNC0830241 C00055 CMP cmp C9H14N3O8P C9H12N3O8P -2 323.0519 63-37-6 CMP CMP

GSMNC0830242 C05673 Null Null C11H20N4O10P2 Null Null 430.0655 Null CMPAEP

CMP-2-aminoethylphosphonate; CMPciliatine

GSMNC0830243 C04121 CMP-KDO ckdo C17H26N3O15P C17H24N3O15P -2 543.1102 Null CMPKDO

CMP-2-keto-3-deoxyoctanoate

GSMNC0830244 C00386 carn

CARNOSINE C9H14N4O3 Null Null 226.1066 305-84-0 Carnosine CNS

GSMNC0830245 C00011 co2

CARBON-DIOXIDE CO2 CO2 0 43.9898 124-38-9 CO2 CO2

GSMNC0830246 C00010 CO-A coa C21H36N7O16P3SC21H32N7O16P3S

-4 767.1152 85-61-0 COA

CoA; coenzyme A

GSMNC0830247 C01302 2cpr5p

CARBOXYPHENYLAMINO-DEOXYRIBULOSE-P

C12H16NO9P C12H13NO9P -3 349.0563 Null CPAD5P

1-(2-Carboxyphenylamino)-1-deoxy-D-ribulose 5-phosphate

GSMNC0830248 C03263 cpppg3 C36H44N4O8

COPROPORPHYRINOGEN_III C36H40N4O8 -4 CPP

660.3159 2624-63-7 Coproporphyrinogen III

GSMNC0830249 C05768 Null

COPROPORPHYRINOGEN_I C36H44N4O8 Null Null 660.3159 Null CPPI

Coproporphyrinogen I

GSMNC0830250 C00300 CREATINEcreat C4H9N3O2 C4H9N3O2 0 131.0695 57-00-1 alpha-Methylguanidino acetic acid; Methylglycocyamine

Creatine;CRTN

GSMNC0830251 C00856 Null Null C9H14N3O7P(C5H8O5PR)n(C5H8O5PR)n

Null Null Null Null CT

DNA cytosine; Cytosine (in DNA)

GSMNC0830252 C00063 CTP ctp C9H16N3O14P3 C9H12N3O14P3 -4 482.9845 65-47-4 CTP CTP

GSMNC0830253 C05640 Null Null C14H8N2O6 Null Null 300.0382 Null CVN

Cinnavalininate

GSMNC0830254 C00097 CYS cys-L C3H7NO2S C3H7NO2S 0 121.0197 52-90-4 CYS

L-Cysteine

GSMNC0830255 C01419 CYS-GLY cgly C5H10N2O3S C5H10N2O3S 0 L-Cysteinylglycine

178.0412 19246-18-5 Cys-Gly;CYSGLY

GSMNC0830256 C00491 Null Null C6H12N2O4S2 Null Null 240.0238 56-89-3 C

L-Cystine YST

GSMNC0830257 C00506 Lcyst

L-CYSTEATE C3H7NO5S C3H6NO5S -1 169.0045 13100-82-8 L-CysteateCYSTEATE

GSMNC0830258 C03125 Null cystrna C18H26N6O11PSR(C5H8O6PR)n 1

C3H6NOSR Null Null CYSTRNACYS

L-Cysteinyl-tRNA(Cys)

GSMNC0830259 C00475 CYTIDINEcytd C9H13N3O5 C9H13N3O5 0 243.0855 65-46-3 CytidineCYTD

GSMNC0830260 C00345 CPD-29616pgc C6H13O10P C6H10O10P -3 276.0246 Null D6PGC

6-Phospho-D-gluconate

GSMNC0830261 C01304 25dhpp C9H16N5O8P

DIAMINO-OH-PHOSPHORIBOSYLAMINO-PYR

C9H14N5O8P -2 353.0736 Null D6RP5P

2,5-Diamino-6-hydroxy-4-(5'-phosphoribosylamino)-pyrimidine

GSMNC0830262 C04332 dmlz

DIMETHYL-D-RIBITYL-LUMAZINE C13H18N4O6 0

C13H18N4O6 326.1226 Null D8RL

6,7-Dimethyl-8-(1-D-ribityl)lumazine

GSMNC0830263 C00559 dad-2

DEOXYADENOSINE C10H13N5O3 C10H13N5O3 0 251.1018 958-09-8 DA

Deoxyadenosine

GSMNC0830264 C00741 DIACETYLNull C4H6O2 Null Null 86.0368 431-03-8 Biacetyl; Dimethylglyoxal; 2,3-Butanedione

Diacetyl;DAC

GSMNC0830265 C00206 DADP dadp C10H15N5O9P2 C10H12N5O9P2 -3 411.0345 Null dADP DADP

GSMNC0830266 C00133 ala-D

D-ALANINE C3H7NO2 C3H7NO2 0 89.0477 338-69-2 D

D-alanine ALA

GSMNC0830267 C00360 DAMP damp C10H14N5O6P C10H12N5O6P -2 331.0682 653-63-4 dAMP DAMP

GSMNC0830268 C01037 dann

DIAMINONONANOATE C9H20N2O2 C9H21N2O2 1 188.1525 Null DANNA

7,8-Diaminononanoate

GSMNC0830269 C00666 26dap-LL C7H14N2O4

LL-DIAMINOPIMELATE C7H14N2O4 0 190.0954 583-93-7 DAPIM

L,L-2,6-Diaminopimelate

GSMNC0830270 C00402 CPD-302 asp-D C4H7NO4 C4H6NO4 -1 133.0375 1783-96-6 DASP

D-Aspartate

GSMNC0830271 C00131 DATP datp C10H16N5O12P3 C10H12N5O12P3-4 491.0008 1927-31-7 dATP DATP

GSMNC0830272 C15556 db4p C4H9O6P

DIHYDROXY-BUTANONE-P C4H7O6P -2 184.0137 Null DB4P

L-3,4-Dihydroxy-2-butanone 4-phosphate

GSMNC0830273 C00881 dcyt

DEOXYCYTIDINE C9H13N3O4 C9H13N3O4 0 227.0906 951-77-9 DC

Deoxycytidine

GSMNC0830274 C00705 DCDP dcdp C9H15N3O10P2 C9H12N3O10P2 -3 387.0233 Null dCDP DCDP

GSMNC0830275 C00239 DCMP dcmp C9H14N3O7P C9H12N3O7P -2 307.0569 1032-65-1 dCMP DCMP

GSMNC0830276 C00458 DCTP dctp C9H16N3O13P3 C9H12N3O13P3 -4 466.9896 2056-98-6 dCTP DCTP

GSMNC0830277 C00793 cys-D

D-CYSTEINE C3H7NO2S C3H7NO2S 0 121.0197 921-01-7 DCYS

D-Cysteine; D-Amino-3-mercaptopropionic acid

GSMNC0830278 C00330 dgsn

DEOXYGUANOSINEC10H13N5O4 C10H13N5O4 0 267.0968 961-07-9 DG

Deoxyguanosine

GSMNC0830279 C00361 DGDP dgdp C10H15N5O10P2 C10H12N5O10P2-3 427.0294 Null dGDP DGDP

GSMNC0830280 C00819 Null

GLUTAMIDE C5H10N2O3 Null Null 146.0691 5959-95-5 DGLN

D-Glutamine

GSMNC0830281 C00217 D-GLT glu-D C5H9NO4 C5H8NO4 -1 147.0532 6893-26-1 DGLU

D-Glutamate

GSMNC0830282 C00818 glcr

D-GLUCARATE C6H10O8 C6H8O8 -2 210.0376 87-73-0 DGLUCA

D-Glucarate

GSMNC0830283 C02670 Null Null C6H8O6 Null Null 176.0321 32449-92-6 DGLUCL

D-Glucuronolactone

GSMNC0830284 C00258 glyc-R

GLYCERATE C3H6O4 C3H5O4 -1 106.0266 473-81-4 DGLYCERATE

D-glycerate

GSMNC0830285 C00362 DGMP dgmp C10H14N5O7P C10H12N5O7P -2 347.0631 902-04-5 dGMP DGMP

GSMNC0830286 C00641 Null 12dgr C5H6O5R2 Null Null Null Null DGR

1,2-Diacyl-sn-glycerol; 1,2-Diacylglycerol

GSMNC0830287 C00286 DGTP dgtp C10H16N5O13P3 C10H12N5O13P3-4 506.9957 2564-35-4 dGTP DGTP

GSMNC0830288 C00111 dhap C3H7O6P

DIHYDROXY-ACETONE-PHOSPHATEC3H5O6P -2 169.998 57-04-5 DHAP

Glycerone phosphate

GSMNC0830289 C03340 23dhdp C7H7NO4

2-3-DIHYDRODIPICOLINATE C7H5NO4 -2 169.0375 Null DHDP

2,3-Dihydrodipicolinate

GSMNC0830290 C00415 dhf

DIHYDROFOLATE C19H21N7O6 C19H19N7O6 -2 443.1553 4033-27-6 DHF

Dihydrofolate

GSMNC0830291 C05578 Null

DIHYDROXYINDOLE C8H7NO2 Null Null 149.0477 3131-52-0 DHI

5,6-Dihydroxyindole

GSMNC0830292 C02972 Null Null C8H16NOS2R Null Null Null Null DHLIPOYLPROTEIN

Dihydrolipoylprotein

GSMNC0830293 C06007 23dhmp C6H12O4

1-KETO-2-METHYLVALERATE C6H11O4 -1 148.0736 Null DHMP

(R)-2,3-dihydroxy-3-methylpentanoate

GSMNC0830294 C04272 23dhmb

DIOH-ISOVALERATE C5H10O4 C5H9O4 -1 134.0579 Null DHMVA

(R)-2,3-dihydroxy-3-methylbutanoate

GSMNC0830295 C03657 dhna C11H8O4

DIHYDROXYNAPHTHOATE C11H7O4 -1 204.0423 Null DHN

1,4-dihydroxy-2-naphthoate

GSMNC0830296 C04874 dhnpt C9H13N5O4

DIHYDRO-NEO-PTERIN C9H13N5O4 0 255.0968 Null DHP

2-Amino-4-hydroxy-6-(D-erythro-1,2,3-trihydroxypropyl)-7,8-dihydropteridine

GSMNC0830297 C06207 Null Null C8H8O4 Null Null 168.0423 Null DHPA

2,6-Dihydroxyphenylacetate

GSMNC0830298 C04043 34dhpac C8H8O3

34-DIHYDROXYPHENYLACETALDEHYDE C8H8O3 0 152.0473 Null DHPACAL

3,4-Dihydroxyphenylacetaldehyde; Protocatechuatealdehyde

GSMNC0830299 C00966 2dhp

2-DEHYDROPANTOATEC6H10O4 C6H9O4 -1 146.0579 Null DHPANT

2-Dehydropantoate

GSMNC0830300 C00921 dhpt C14H14N6O3

7-8-DIHYDROPTEROATE C14H13N6O3 -1 314.1127 Null DHPT

Dihydropteroate

GSMNC0830301 C02637 3dhsk

3-DEHYDRO-SHIKIMATE C7H8O5 C7H7O5 -1 172.0372 Null DHSK

3-Dehydroshikimate

GSMNC0830302 C01344 didp

CPD0-2231 C10H14N4O10P2 C10H11N4O10P2-3 412.0185 Null dIDP DIDP

GSMNC0830303 C04666 eig3p C6H11N2O6P

D-ERYTHRO-IMIDAZOLE-GLYCEROL-P C6H9N2O6P -2 238.0355 Null DIMGP

D-erythro-1-(Imidazol-4-yl)glycerol 3-phosphate

GSMNC0830304 C06196 DIMP dimp C10H13N4O7P C10H11N4O7P -2 332.0522 Null DIMP

2'-Deoxyinosine 5'-phosphate; dIMP

GSMNC0830305 C05512 din

DEOXYINOSINE C10H12N4O4 C10H12N4O4 0 DIN

252.0859 890-38-0 Deoxyinosine

GSMNC0830306 C04932 lipidAds

BISOHMYR-GLC C68H129N2O20P C68H127N2O20P-2 1324.8876 Null DISAC1P

2,3-bis(3-hydroxytetradecanoyl)-D-glucosaminyl-1,6-beta-D-2,3-bis(3-hydroxytetradecanoyl)-beta-D-glucosamin

GSMNC0830307 C01345 DITP ditp C10H15N4O13P3 C10H11N4O13P3-4 491.9848 Null dITP DITP

GSMNC0830308 C15973 Null Null C8H16NOS2R Null Null Null Null N6-(dihydrolipoyl)lysine; Dihydrolipoamide-E

Enzyme DLIPO

GSMNC0830309 C03114 dmbzid

DIMETHYLBENZIMIDAZOLEC9H10N2 C9H10N2 0 DMB

146.0844 582-60-5 Dimethylbenzimidazole

GSMNC0830310 C05818 2dmmq8

DEMETHYLMENAQUINONE C15H14O2(C5H8)n 50H70O2

C 0 Null Null DMK

2-Demethylmenaquinone

GSMNC0830311 Null Null 2dmmql8 Null Null Null Null Null DMKH2

2-Demethylmenaquinol

GSMNC0830312 C00235 CPD-4211dmpp C5H12O7P2 C5H9O7P2 -3 Dimethylallyl diphosphate

246.0058 358-71-4;358-72-5 DMPP

GSMNC0830313 C00039 Null

DEOXYNUCLEOTIDESM C10H17O8PR2(C5H8O5PR)n

Null Null Null DNA

9007-49-2 DNA (biomass component)

GSMNC0830314 C00337 dhor-S

DI-H-OROTATE C5H6N2O4 C5H5N2O4 -1 DOROA

158.0328 5988-19-2 (S)-Dihydroorotate

GSMNC0830315 C01693 Null

L-DOPACHROME C9H7NO4 Null Null 193.0375 Null DPCHR

L-Dopachrome; 2-L-Carboxy-2,3-dihydroindole-5,6-quinone

GSMNC0830316 C00882 dpcoa

DEPHOSPHO-COA C21H35N7O13P2SC21H33N7O13P2S -2 687.1489 Null DPCOA

Dephospho-CoA

GSMNC0830317 C02265 CPD-216 Null C9H11NO2 Null Null DPHE

165.079 673-06-3 D-Phenylalanine

GSMNC0830318 C03758 DOPAMINEdopa C8H11NO2 C8H12NO2 1 153.079 51-61-6 DPM

Dopamine; 4-(2-Aminoethyl)-1,2-benzenediol; 4-(2-Aminoethyl)benzene-1,2-diol; 3,4-Dihydroxyphenethylamine

GSMNC0830319 C00763 Null

D-PROLINE C5H9NO2 Null Null D

115.0633 344-25-2 D-Proline PRO

GSMNC0830320 C00944 3dhq

DEHYDROQUINATEC7H10O6 C7H9O6 -1 190.0477 Null DQT

3-Dehydroquinate

GSMNC0830321 C00672 2dr1p

DEOXY-RIBOSE-1P C5H11O7P C5H9O7P -2 214.0242 Null DR1P

2-Deoxy-D-ribose 1-phosphate

GSMNC0830322 C00673 2dr5p

DEOXY-RIBOSE-5P C5H11O7P C5H9O7P -2 DR5P

214.0242 102916-66-52-Deoxy-D-ribose 5-phosphate

GSMNC0830323 C00740 s

D-SERINEer-D C3H7NO3 C3H7NO3 0 105.0426 312-84-5 D-SerineDSER

GSMNC0830324 C00214 thymd

THYMIDINE C10H14N2O5 C10H14N2O5 0 242.0903 50-89-5 ThymidineDT

GSMNC0830325 C01909 dtbt

DETHIOBIOTIN C10H18N2O3 C10H17N2O3 -1 DTB

214.1317 533-48-2 Dethiobiotin

GSMNC0830326 C00363 DTDP dtdp C10H16N2O11P2 C10H13N2O11P2-3 402.0229 491-97-4 dTDP DTDP

GSMNC0830327 C11907 dtdp4d6dg;dtdpddg

C16H24N2O15P2 C16H22N2O15P2-2 546.0652 Null

DTDP-DEOH-DEOXY-GLUCOSE;DTDP-4-DEHYDRO-6-DEOXY-D-GALACTOSE DTDP4O6DG

4,6-Dideoxy-4-oxo-dTDP-D-glucose; dTDP-4-oxo-6-deoxy-D-glucose; dTDP-4-dehydro-6-deoxy-D-glucose; dT

GSMNC0830328 C00688 DTDP-DEOH-DEOXY-MANNOSE

dtdp4d6dm;dtdpddm

C16H24N2O15P2 Null Null 546.0652 Null DTDP4ORMNS

dTDP-4-dehydro-6-deoxy-L-mannose; dTDP-4-oxo-6-deoxy-L-mannose; dTDP-4-oxo-L-rhamnose

GSMNC0830329 C02097 Null

DTDP-D-GALACTOSE C16H26N2O16P2 Null Null 564.0758 Null DTDPGLAC

dTDPgalactose

GSMNC0830330 C00842 dtdpglc;dtdpglu

DTDP-D-GLUCOSE C16H26N2O16P2 C16H24N2O16P2-2 dTDP-glucose; dTDP-D-glucose; dTDP-alpha-D-glucose

564.0758 2009-24-7;2196-62-5DTDPGLU

GSMNC0830331 C03319 dtdp6dm

DTDP-RHAMNOSE C16H26N2O15P2 Null Null 548.0808 Null DTDPRMNS

dTDP-6-deoxy-L-mannose; dTDP-L-rhamnose

GSMNC0830332 C00364 DTMP dtmp C10H15N2O8P C10H13N2O8P -2 322.0566 365-07-1 dTMP DTMP

GSMNC0830333 C00459 DTTP dttp C10H17N2O14P3 C10H13N2O14P3-4 481.9893 Null dTTP DTTP

GSMNC0830334 C00526 duri

DEOXYURIDINE C9H12N2O5 C9H12N2O5 0 DU

228.0746 951-78-0 Deoxyuridine

GSMNC0830335 C01346 DUDP dudp C9H14N2O11P2 C9H11N2O11P2 -3 388.0073 Null dUDP DUDP

GSMNC0830336 C00365 DUMP dump C9H13N2O8P C9H11N2O8P -2 308.041 964-26-1 dUMP DUMP

GSMNC0830337 C00460 DUTP dutp C9H15N2O14P3 C9H11N2O14P3 -4 467.9736 Null dUTP DUTP

GSMNC0830338 C11437 dxyl5p

DEOXYXYLULOSE-5P C5H11O7P C5H9O7P -2 214.0242 Null DX5P

1-Deoxy-D-xylulose 5-phosphate

GSMNC0830339 C05947 e4hglu C5H9NO5

L-ERYTHRO-4-HYDROXY-GLUTAMATE C5H8NO5 -1 163.0481 Null E4HGLU

L-erythro-4-Hydroxyglutamate

GSMNC0830340 C00279 e4p

ERYTHROSE-4P C4H9O7P C4H7O7P -2 E4P

200.0086 585-18-2 D-Erythrose 4-phosphate

GSMNC0830341 C03393 4per

ERYTHRONATE-4P C4H9O8P C4H6O8P -3 216.0035 Null ER4P

4-Phospho-D-erythronate; 4-Phosphoerythronate

GSMNC0830342 C00469 ETOH etoh C2H6O C2H6O 0 46.0419 64-17-5 Ethanol ETH

GSMNC0830343 C00189 etha

ETHANOL-AMINE C2H7NO C2H8NO 1 61.0528 141-43-5 EthanolamineETHA

GSMNC0830344 Null C2H8NO4P

C00346 PHOSPHORYL-ETHANOLAMINE Null Null 141.0191 ETHAP

1071-23-4 Ethanolamine phosphate; O-Phosphorylethanolamine; Phosphoethanolamine; O-Phosphoethanolamine

GSMNC0830345 Null Null Null Null Null Null Null Null EXOPOLYS

Exopolysaccharide

GSMNC0830346 C01094 Null f1p C6H13O9P Null Null 260.0297 F1P

15978-08-2 D-Fructose 1-phosphate

GSMNC0830347 C05345 Null Null C6H13O9P Null Null 260.0297 Null F6P

beta-D-Fructose 6-phosphate

GSMNC0830348 frmd

C00488 FORMAMIDE CH3NO Null Null 45.0215 75-12-7 Formamide FA

GSMNC0830349 C00016 FAD fad C27H33N9O15P2 C27H31N9O15P2-2 785.1571 FAD

146-14-5 Flavin adenine dinucleotide; FAD

GSMNC0830350 C01352 FADH2 fadh2 C27H35N9O15P2 C27H33N9O15P2-2 787.1728 Null FADH2 FADH2

GSMNC0830351 Null

C05653 N-FORMYLANTHRANILATEC8H7NO3 Null Null 165.0426 FAN

3342-77-6 Formylanthranilate; N-Formylanthranilate; 2-(Formylamino)-benzoic acid

GSMNC0830352 C05378 Null Null C6H14O12P2 Null Null 339.996 Null FDP

beta-D-Fructose 1,6-bisphosphate

GSMNC0830353 C00125 Null ficytcc Null Null Null Null Null FERIC

Ferricytochrome c

GSMNC0830354 C00126 Null focytcc Null Null Null Null Null FEROC

Ferrocytochrome c

GSMNC0830355 fpram C8H16N3O8P

C04640 5-PHOSPHORIBOSYL-N-FORMYLGLYCINEAMIDINE -1

C8H15N3O8P 313.0675 Null FGAM

2-(Formamido)-N1-(5'-phosphoribosyl)acetamidine

GSMNC0830356 fgam C8H15N2O9P

C04376 5-P-RIBOSYL-N-FORMYLGLYCINEAMIDE C8H13N2O9P -2 314.0515 Null FGAR

5'-Phosphoribosyl-N-formylglycinamide

GSMNC0830357 Lfmkynr

C02700 N-FORMYLKYNURENINE C11H12N2O4 Null Null 236.0797 FKYN

1022-31-7 L-Formylkynurenine; N-Formyl-L-kynurenine; N-Formylkynurenine

GSMNC0830358 C00504 Null fol C19H19N7O6 Null Null 441.1397 59-30-3 Folate FL

GSMNC0830359 C03294 Null fmettrna C21H30N6O12PSR(C5H8O6PR)n 0

C6H9NO2SR Null Null FMETTRNA

N-Formylmethionyl-tRNA

GSMNC0830360 C00061 FMN fmn C17H21N4O9P C17H19N4O9P -2 456.1046 FMN

146-17-8 FMN; Riboflavin-5-phosphate; Flavin mononucleotide

GSMNC0830361 C00058 FORMATE for CH2O2 CH1O2 -1 46.0055 64-18-6 Formate FORMATE

GSMNC0830362 frdp

C00448 FARNESYL-PP C15H28O7P2 C15H25O7P2 -3 382.131 trans,trans-Farnesyl diphosphate

13058-04-3;372-97-4FPP

GSMNC0830363 N

C00095[e] ull fru[e] C6H12O6 C6H12O6 0 180.0634 57-48-7 D-fructose

External FRUxt

GSMNC0830364 10fthf

C00234 10-FORMYL-THF C20H23N7O7 C20H21N7O7 -2 473.1659 Null FTHF

10-Formyltetrahydrofolate

GSMNC0830365 fc1p

C01099 FUCULOSE-1P C6H13O8P C6H11O8P -2 244.0348 Null FUCP

L-Fuculose 1-phosphate

GSMNC0830366 C00122 FUM fum C4H4O4 C4H2O4 -2 116.011 110-17-8 Fumarate FUM

GSMNC0830367 C00103 GLC-1-P g1p C6H13O9P C6H11O9P -2 260.0297 59-56-3 G1P

D-Glucose 1-phosphate

GSMNC0830368 C00118 GAP g3p C3H7O6P Null Null 169.998 G3P

591-57-1 D-Glyceraldehyde 3-phosphate; (2R)-2-Hydroxy-3-(phosphonooxy)-propanal

GSMNC0830369 g3pc C8H21NO6P

C00670 L-1-GLYCERO-PHOSPHORYLCHOLINE C8H20NO6P 0 258.1106 Null G3PC

sn-glycero-3-Phosphocholine

GSMNC0830370 g3pe C5H14NO6P

C01233 L-1-GLYCEROPHOSPHORYLETHANOL-AMINEC5H14NO6P 0 215.0559 Null G3PE

sn-glycero-3-Phosphoethanolamine

GSMNC0830371 g6p-A

C00668 ALPHA-GLC-6-P C6H13O9P Null Null 260.0297 Null G6P

alpha-D-Glucose 6-phosphate

GSMNC0830372 gam1p

C06156 GLUCOSAMINE-1P C6H14NO8P C6H13NO8P -1 259.0457 Null GA1P

D-Glucosamine 1-phosphate

GSMNC0830373 gam6p

C00352 D-GLUCOSAMINE-6-P C6H14NO8P C6H13NO8P -1 259.0457 GA6P

3616-42-0 D-Glucosamine 6-phosphate

GSMNC0830374 4abut

C00334 4-AMINO-BUTYRATE C4H9NO2 C4H9NO2 0 103.0633 56-12-2 GABA

4-Aminobutanoate

GSMNC0830375 C06114 Null Null C8H13N3O3 Null Null 199.0957 Null GAPN

gamma-Glutamyl-beta-aminopropiononitrile; gamma-Glutamyl-3-aminopropiononitrile

GSMNC0830376 gar C7H15N2O8P

C03838 5-PHOSPHO-RIBOSYL-GLYCINEAMIDE C7H14N2O8P -1 286.0566 Null GAR

5'-Phosphoribosylglycinamide

GSMNC0830377 glucys C8H14N2O5S

C00669 L-GAMMA-GLUTAMYLCYSTEINE C8H13N2O5S -1 250.0623 GCYS

636-58-8 gamma-L-Glutamyl-L-cysteine

GSMNC0830378 C00035 GDP gdp C10H15N5O11P2 C10H12N5O11P2-3 443.0243 146-91-8 GDP GDP

GSMNC0830379 gdpman

C00096 GDP-MANNOSE C16H25N5O16P2 C16H23N5O16P2-2 605.0772 3123-67-9 GDP-mannoseGDPMAN

GSMNC0830380 C05585 Null Null C7H6O3 Null Null 138.0317 Null GENAL

Gentisate aldehyde

GSMNC0830381 C05695 Null Null C9H16N2O5Se Null Null 312.0224 Null GGLUMSCYS

gamma-Glutamyl-Se-methylselenocysteine

GSMNC0830382 ggdp

C00353 GERANYLGERANYL-PP C20H36O7P2 Null Null 450.1936 GGPP

6699-20-3 Geranylgeranyl diphosphate

GSMNC0830383 C00116 GLYCEROLglyc C3H8O3 C3H8O3 0 92.0473 56-81-5 GlycerolGL

GSMNC0830384 glyc3p

C00093 GLYCEROL-3P C3H9O6P C3H7O6P -2 172.0137 GL3P

17989-41-2 sn-Glycerol 3-phosphate

GSMNC0830385 gcald

C00266 GLYCOLALDEHYDEC2H4O2 C2H4O2 0 60.0211 GLAL

141-46-8 Glycolaldehyde

GSMNC0830386 a-D-glucose

C00267 ALPHA-GLUCOSE C6H12O6 C6H12O6 0 180.0634 GLC

492-62-6 alpha-D-Glucose

GSMNC0830387 C00329 gam

GLUCOSAMINE C6H13NO5 C6H14NO5 1 179.0794 GLCA

3416-24-8 D-Glucosamine; Chitosamine; 2-Amino-2-deoxy-D-glucose

GSMNC0830388 C06023 Null Null C12H24N2O10(C6H11NO3)n

Null Null Null Null GLCAMN

D-Glucosaminide

GSMNC0830389 C00064 GLN gln-L C5H10N2O3 C5H10N2O3 0 146.0691 56-85-9 GLN

L-Glutamine

GSMNC0830390 C00025 GLT glu-L C5H9NO4 C5H8NO4 -1 147.0532 56-86-0 GLU

L-Glutamate

GSMNC0830391 C05711 Null Null C9H13N3O5 Null Null 243.0855 Null GLUBCALA

gamma-Glutamyl-beta-cyanoalanine

GSMNC0830392 C00257 glcn-D

GLUCONATE C6H12O7 C6H11O7 -1 196.0583 526-95-4 D-Gluconate GLUC

GSMNC0830393 C01165 glu5sa C5H9NO3

L-GLUTAMATE_GAMMA-SEMIALDEHYDE C5H9NO3 0 131.0582 Null GLUGSAL

L-Glutamate 5-semialdehyde

GSMNC0830394 C03287 glu5p

L-GLUTAMATE-5-P C5H10NO7P C5H8NO7P -2 227.0195 Null GLUP

alpha-D-Glutamyl phosphate

GSMNC0830395 C00527 glutcoa

GLUTARYL-COA C26H42N7O19P3SNull Null 881.1469 GLUTCOA

3131-84-8 Glutaryl-CoA

GSMNC0830396 C05844 Null Null C7H14N2O6S Null Null 254.0573 Null GLUTR

5-L-Glutamyl-taurine

GSMNC0830397 C06112 Null glutrna(gln) C20H28N6O13PR(C5H8O6PR)n 0

C5H7NO3R Null Null GLUTRNAGLN

L-Glutamyl-tRNA(Gln)

GSMNC0830398 C02987 Null glutrna C20H28N6O13PR(C5H8O6PR)n 0

C5H7NO3R Null Null GLUTRNAGLU

L-Glutamyl-tRNA(Glu)

GSMNC0830399 C00048 GLYOX glx C2H2O3 C2H1O3 -1 74.0004 298-12-4 Glyoxylate GLX

GSMNC0830400 C00037 GLY gly C2H5NO2 C2H5NO2 0 75.032 56-40-6 Glycine GLY

GSMNC0830401 C00160 glyclt

GLYCOLLATE C2H4O3 C2H3O3 -1 76.016 79-14-1 G

Glycolate LYCOLATE

GSMNC0830402 C02412 Null glytrna C12H20NO11PR2(C5H8O6PR)n 1

C2H4NOR Null Null GLYTRNAGLY

Glycyl-tRNA(Gly)

GSMNC0830403 C00144 GMP gmp C10H14N5O8P C10H12N5O8P -2 363.058 85-32-5 GMP GMP

GSMNC0830404 C00242 g

GUANINEua C5H5N5O C5H5N5O 0 151.0494 73-40-5 Guanine GN

GSMNC0830405 C00341 grdp

GERANYL-PP C10H20O7P2 C10H17O7P2 -3 314.0684 Null GPP

Geranyl diphosphate

GSMNC0830406 C03741 glu1sa C5H9NO3

GLUTAMATE-1-SEMIALDEHYDE C5H9NO3 0 131.0582 Null GSA

Glutamate-1-semialdehyde

GSMNC0830407 C00387 gsn

GUANOSINE C10H13N5O5 C10H13N5O5 0 283.0917 118-00-3 Guanosine GSN

GSMNC0830408 C00044 GTP gtp C10H16N5O14P3 C10H12N5O14P3-4 522.9907 GTP

29951;86-01-1 GTP

GSMNC0830409 C02282 Null glntrna C20H29N7O12PR(C5H8O6PR)n 1

C5H9N2O2R Null Null GTRNA

Glutaminyl-tRNA

GSMNC0830410 C06250 Null Null C17H27N5O4SR2 Null Null Null Null H[C]

Holo-[carboxylase]

GSMNC0830411 C00027 h2o2

HYDROGEN-PEROXIDE H2O2 H2O2 0 34.0055 7722-84-1 H2O2 H2O2

GSMNC0830412 C00283 Null h2s H2S H2S 0 33.9877 Hydrogen sulfide

2147416;2148878 H2S

GSMNC0830413 C00094 H2SO3 so3 H2SO3 O3S -2 81.9725 7782-99-2 Sulfite H2SO3

GSMNC0830414 C05565 Null C6H8N2O4

HYDANTOIN-5-PROPIONATE Null Null 172.0484 Null H5P

Hydantoin-5-propionate; Hydantoin-propionate

GSMNC0830415 C05235 ACETOLacetol C3H6O2 C3H6O2 0 74.0368 HAC

116-09-6 Hydroxyacetone

GSMNC0830416 C00884 Null Null C10H16N4O3 Null Null 240.1222 HCNS

3650-73-5 Homocarnosine

GSMNC0830417 C00288 HCO3 hco3 HCO3 CHO3 -1 60.9926 71-52-3 HCO3 HCO3

GSMNC0830418 C00155 HOMO-CYShcys-L C4H9NO2S C4H9NO2S 0 135.0354 HCYS

6027-13-0 L-Homocysteine

GSMNC0830419 C06199 Null Null C10H15NO Null Null 165.1154 HDN

539-15-1 Hordenine; 4-[2-(Dimethylamino)ethyl]phenol

GSMNC0830420 C03981 Null

ENOL-OXALOACETATE C4H4O5 Null Null 132.0059 Null HEDC

2-Hydroxyethylenedicarboxylate; enol-Oxaloacetate; enol-Oxaloacetic acid; 2-Hydroxybut-2-enedioic acid

GSMNC0830421 C15672 HEME_OhemeO C49H58FeN4O5 C49H56FeN4O5 -2 838.3757 137397-56-9Heme O HEMEO

GSMNC0830422 C04216 hepdp C35H60O7P2

ALL-TRANS-HEPTAPRENYL-DIPHOSPHATE Null Null 654.3814 Null HEPPP

all-trans-Heptaprenyl diphosphate

GSMNC0830423 C06001 Null 3hmp C4H8O3 Null Null 104.0473 Null HIBUT

(S)-3-Hydroxyisobutyrate

GSMNC0830424 C00388 hista

HISTAMINE C5H9N3 Null Null 111.0796 51-45-6 HIEA

1H-Imidazole-4-ethanamine; Histamine; 2-(4-Imidazolyl)ethylamine

GSMNC0830425 C01586 CPD-425 Null C9H9NO3 Null Null 179.0582 HIPPRT

495-69-2 Hippurate; Hippuric acid; N-Benzoylglycine; Benzoylaminoacetic acid

GSMNC0830426 C00135 HIS his-L C6H9N3O2 C6H9N3O2 0 155.0695 71-00-1 HIS

L-Histidine

GSMNC0830427 C00860 histd

HISTIDINOL C6H11N3O C6H12N3O 1 141.0902 Null HISOL

L-Histidinol

GSMNC0830428 C01100 hisp

L-HISTIDINOL-P C6H12N3O4P C6H11N3O4P -1 221.0565 HISOLP

25679-93-0 L-Histidinol phosphate

GSMNC0830429 C02988 Null histrna C16H24N3O11PR2(C5H8O6PR)n 1

C6H8N3OR Null Null HISTRNAHIS

L-Histidyl-tRNA(His)

GSMNC0830430 Null C10H12N2O4

C03227 3-HYDROXY-L-KYNURENINE Null Null HKYN

224.0797 606-14-4 3-Hydroxy-L-kynurenine

GSMNC0830431 hmbil

C01024 HYDROXYMETHYLBILANEC40H46N4O17 C40H38N4O17 -8 HMB

854.2858 73023-76-4 Hydroxymethylbilane

GSMNC0830432 h2mb4p C5H12O8P2

C11811 HYDROXY-METHYL-BUTENYL-DIP C5H9O8P2 -3 262.0007 Null HMB4PP

1-Hydroxy-2-methyl-2-butenyl 4-diphosphate

GSMNC0830433 C00320 S2O3 tsul H2S2O3 O3S2 -2 112.9367 Null HO3S2

Thiosulfate

GSMNC0830434 Null

C00544 HOMOGENTISATE C8H8O4 Null Null 168.0423 451-13-8 HomogentisateHOMOGEN

GSMNC0830435 2h3opp;2h3oppan

C01146 TARTRONATE-S-ALD C3H4O4 C3H3O4 -1 104.011 Null HOPP

2-Hydroxy-3-oxopropanoate; Tartronate semialdehyde

GSMNC0830436 C00168 OH-PYR hpyr C3H4O4 C3H3O4 -1 HPYR

104.011 1113-60-6 Hydroxypyruvate; Hydroxypyruvic acid; 3-Hydroxypyruvate; 3-Hydroxypyruvic acid

GSMNC0830437 C00263 HOMO-SERhom-L C4H9NO3 C4H9NO3 0 119.0582 672-15-1 L-Homoserine HSER

GSMNC0830438 P

C00080[e] ROTONh[e] H H 1 1.0078 proton

12408-02-5 External Hxt

GSMNC0830439 4h2oglt C5H6O6

C01127 D-4-HYDROXY-2-KETO-GLUTARATE C5H4O6 -2 162.0164 Null HYDROXYAKG

D-4-Hydroxy-2-oxoglutarate

GSMNC0830440 hxan

C00262 HYPOXANTHINE C5H4N4O C5H4N4O 0 136.0385 68-94-0 HYXN

Hypoxanthine

GSMNC0830441 Null

C00637 INDOLE_ACETALDEHYDEC10H9NO Null Null I3AA

159.0684 2591-98-2 Indole-3-acetaldehyde

GSMNC0830442 C02693 CPD-237 iad C10H10N2O Null Null I3AAM

174.0793 879-37-8 Indole-3-acetamide

GSMNC0830443 ind3ac C10H9NO2

C00954 INDOLE_ACETATE_AUXIN Null Null 175.0633 87-51-4 I3AC

Indole-3-acetate

GSMNC0830444 Null C5H6N2O

C05130 IMIDAZOLE_ACETALDEHYDE Null Null I4AA

110.048 645-14-7 Imidazole-4-acetaldehyde

GSMNC0830445 Null

C02835 4-IMIDAZOLEACETATE C5H6N2O2 Null Null I4AC

126.0429 645-65-8 Imidazole-4-acetate

GSMNC0830446 iasp

C05840 IMINOASPARTATE C4H5NO4 C4H3NO4 -2 131.0219 Null IASP

Iminoaspartate

GSMNC0830447 ichor

C00885 ISOCHORISMATE C10H10O6 C10H8O6 -2 226.0477 Null ICHOR

Isochorismate

GSMNC0830448 icit C6H8O7

C00311 THREO-DS-ISO-CITRATE C6H5O7 -3 IsocitrateICIT

192.027 30810-51-6;320-77-4

GSMNC0830449 C00104 IDP idp C10H14N4O11P2 C10H11N4O11P2-3 428.0134 86-04-4 IDP IDP

GSMNC0830450 C15809 Null Null C2H3NO2 Null Null IGLY

73.0164 4472-12-2 Iminoglycine; Iminoacetic acid

GSMNC0830451 3ig3p

C03506 INDOLE-3-GLYCEROL-PC11H14NO6P C11H12NO6P -2 287.0559 Null IGP

Indoleglycerol phosphate

GSMNC0830452 C00407 ILE ile-L C6H13NO2 C6H13NO2 0 131.0946 73-32-5 ILE

L-Isoleucine

GSMNC0830453 C03127 Null iletrna C21H32N6O11PR(C5H8O6PR)n 1

C6H12NOR Null Null ILETRNAILE

L-Isoleucyl-tRNA(Ile)

GSMNC0830454 imacp

C01267 IMIDAZOLE-ACETOL-P C6H9N2O5P C6H7N2O5P -2 220.0249 Null IMACP

3-(Imidazol-4-yl)-2-oxopropyl phosphate

GSMNC0830455 C00252 Null Null C12H22O11 Null Null 342.1162 499-40-1 Isomaltose IMAL

GSMNC0830456 C00130 IMP imp C10H13N4O8P C10H11N4O8P -2 348.0471 131-99-7 IMP IMP

GSMNC0830457 C00463 INDOLE indole C8H7N C8H7N 0 117.0578 120-72-9 Indole INDOLE

GSMNC0830458 C00294 INOSINEins C10H12N4O5 C10H12N4O5 0 268.0808 58-63-9 Inosine INS

GSMNC0830459 ipdp C5H12O7P2

C00129 DELTA3-ISOPENTENYL-PP C5H9O7P2 -3 IPP

246.0058 358-71-4 Isopentenyl diphosphate

GSMNC0830460 3c3hmp C7H12O5

C02504 3-CARBOXY-3-HYDROXY-ISOCAPROATE C7H10O5 -2 176.0685 Null IPPMAL

2-Isopropylmalate; (2S)-2-Isopropylmalate; 3-Carboxy-3-hydroxy-4-methylpentanoate; 3-Carboxy-3-hydroxy-iso

GSMNC0830461 indpyr

C00331 INDOLE_PYRUVATEC11H9NO3 Null Null IPYR

203.0582 35656-49-6 Indolepyruvate; Indolepyruvic acid; (Indol-3-yl)pyruvate; Indole-3-pyruvate; 3-(Indol-3-yl)pyruvate

GSMNC0830462 C00081 ITP itp C10H15N4O14P3 C10H11N4O14P3-4 507.9798 132-06-9 ITP ITP

GSMNC0830463 lipa

C06026 KDO2-LIPID-A C110H202N2O39P2

C110H196N2O39P2

-6 2237.336 Null K2LIPA

KDO2-lipid (A); Di[3-deoxy-D-manno-octulosonyl]-lipid A

GSMNC0830464 kdo2lipid4 C84H154N2O37P2C84H148N2O37P2

C06025 KDO2-LIPID-IVA -6 1844.9706 Null K2LIPIV

KDO2-lipid IV(A); Di[3-deoxy-D-manno-octulosonyl]-lipid IV(A);

GSMNC0830465 C01187 KDO kdo C8H14O8 C8H13O8 -1 238.0689 Null KDO

2-Dehydro-3-deoxy-D-octonate

GSMNC0830466 kdolipid4 C76H142N2O30P2C76H137N2O30P2

C06024 KDO-LIPID-IVA -5 1624.9123 Null KDOLIPIV

KDO-lipid IV(A)

GSMNC0830467 C04478 KDO-8P kdo8p C8H15O11P C8H12O11P -3 318.0352 Null KDOP

2-Dehydro-3-deoxy-D-octonate 8-phosphate

GSMNC0830468 2ddg6p C6H11O9P

C04442 2-KETO-3-DEOXY-6-P-GLUCONATE C6H8O9P -3 258.0141 Null KDPG

2-Dehydro-3-deoxy-6-phospho-D-gluconate

GSMNC0830469 Lkynr

C00328 L-KYNURENINE C10H12N2O3 Null Null KYN

208.0848 2922-83-0 L-Kynurenine; 3-Anthraniloyl-L-alanine

GSMNC0830470 1p3h5c C5H7NO3

C04281 PYRROLINE-HYDROXY-CARBOXYLATE C5H6NO3 -1 L1P3H5C

129.0426 5255-75-4 L-1-Pyrroline-3-hydroxy-5-carboxylate

GSMNC0830471 lac-D

C00256 D-LACTATE C3H6O3 C3H5O3 -1 LAC

90.0317 10326-41-7 (R)-Lactate, D-Lactate

GSMNC0830472 C00424 LACTALD lald-L C3H6O2 C3H6O2 0 LACAL

74.0368 598-35-6 (S)-Lactaldehyde; L-Lactaldehyde; L-2-Hydroxypropionaldehyde

GSMNC0830473 C00123 LEU leu-L C6H13NO2 C6H13NO2 0 131.0946 61-90-5 L-LeucineLEU

GSMNC0830474 C02047 Null leutrna C21H32N6O11PR(C5H8O6PR)n 1

C6H12NOR Null Null LEUTRNA

L-Leucyl-tRNA

GSMNC0830475 Null Null Null Null Null Null Null Null LIPID

Lipids other than phospholipid

GSMNC0830476 C04919 lipidA

LIPID-IV-A C68H130N2O23P2C68H126N2O23P2

-4 1404.854 Null LIPIV

Lipid IV(A)

GSMNC0830477 C15972 Null Null C8H14NOS2R Null Null Null Null N6-(lipoyl)lysine; Lipoamide-E

Enzyme LIPO

GSMNC0830478 C02051 Null Null C8H14NOS2R Null Null Null Null LIPOYLPROTEIN

Lipoylprotein

GSMNC0830479 C04824 lipidX C34H66NO12P C34H64NO12P -2

BISOHMYR-GLUCOSAMINYL-1P 711.4323 Null Lipid X LIPX

GSMNC0830480 C06251 kdo2lipid4L C96H176N2O38P2C96H170N2O38P2

KDO2-LAUROYL-LIPID-IVA -6 2027.1376 Null LK2LIPIV

Lauroyl-KDO2-lipid IV(A)

GSMNC0830481 C02291 Null cysth-L;cyst-L

C7H14N2O4S C7H14N2O4S 0 222.0674 56-88-2 LLCT

L-Cystathionine

GSMNC0830482 C00338 Null Null Null Null Null Null Null LPS

Lippolysaccharide

GSMNC0830483 C03451 lgt-S

S-LACTOYL-GLUTATHIONEC13H21N3O8S Null Null 379.1049 Null LTG

(R)-S-Lactoylglutathione

GSMNC0830484 C00047 LYS lys-L C6H14N2O2 C6H15N2O2 1 146.1055 56-87-1 L-LysineLYS

GSMNC0830485 C01931 Null lystrna C16H29N2O11PR2(C5H8O6PR)n 2

C6H14N2OR Null Null LYSTRNA

L-Lysyl-tRNA

GSMNC0830486 C00149 MAL mal-L C4H6O5 C4H4O5 -2 134.0215 97-67-6 MAL

(S)-Malate

GSMNC0830487 C01209 Null malacp C3H3O3SR C14H22N2O10PRS

-2 Null Null MALACP

Malonyl-[acyl-carrier protein]

GSMNC0830488 C00083 malcoa

MALONYL-COA -5

C24H38N7O19P3SC24H33N7O19P3S 853.1156 524-14-1 Malonyl-CoA MALCOA

GSMNC0830489 C00636 man1p

MANNOSE-1P C6H13O9P C6H11O9P -2 260.0297 Null MAN1P

alpha-D-Mannose 1-phosphate

GSMNC0830490 C00275 man6p

MANNOSE-6P C6H13O9P C6H11O9P -2 260.0297 Null MAN6P

D-Mannose 6-phosphate

GSMNC0830491 C06453 Null Null C63H91CoN13O14P

Null Null MCB

1343.5878 13422-55-4 Methylcobalamin

GSMNC0830492 C00680 26dap-m

MESO-DIAMINOPIMELATE C7H14N2O4 C7H14N2O4 0 190.0954 Null MDAPIM

meso-2,6-Diaminoheptanedioate; meso-2,6-Diaminopimelate; meso-2,6-Diaminopimelic acid; meso-Diaminohep

GSMNC0830493 C11434 2me4p C5H13O7P

2-C-METHYL-D-ERYTHRITOL-4-PHOSPHATEC5H11O7P -2 216.0399 Null MDE4P

2-C-Methyl-D-erythritol 4-phosphate

GSMNC0830494 C11453 2mecdp

2C-METH-D-ERYTHRITOL-CYCLODIPHOSPHATE

C5H12O9P2 C5H10O9P2 -2 MDECPP

277.9957 143488-44-22-C-Methyl-D-erythritol 2,4-cyclodiphosphate

GSMNC0830495 C00073 MET met-L C5H11NO2S C5H11NO2S 0 149.051 63-68-3 MET

L-Methionine

GSMNC0830496 C00445 methf

5-10-METHENYL-THF C20H22N7O6 C20H20N7O6 -1 456.1632 Null METHF

5,10-Methenyltetrahydrofolate

GSMNC0830497 C00143 mlthf

METHYLENE-THF C20H23N7O6 C20H21N7O6 -2 METTHF

457.171 3432-99-3 5,10-Methylenetetrahydrofolate

GSMNC0830498 C02430 Null mettrna C20H30N6O11PSR(C5H8O6PR)n 1

C5H10NOSR Null Null METTRNA

L-Methionyl-tRNA

GSMNC0830499 C00828 Null

CPD-9728;CPD-9730 C16H16O2(C5H8)n ull

N Null Null MK

11032-49-8 menaquinone

GSMNC0830500 C05819 Null

REDUCED-MENAQUINONE C16H18O2(C5H8)n ull

N Null Null Null MKH2

menaquinol

GSMNC0830501 C00208 Null malt C12H22O11 C12H22O11 0 342.1162 69-79-4 Maltose MLT

GSMNC0830502 C02170 CPD-546 Null C4H6O4 Null Null MM

118.0266 516-05-2 Methylmalonate

GSMNC0830503 C00683 mmcoa-s

D-METHYL-MALONYL-COA C25H40N7O19P3SC25H35N7O19P3S

-5 867.1313 Null MMALCOA

(S)-Methylmalonyl-CoA; (S)-Methylmalonyl-coenzyme A; (2S)-Methylmalonyl-CoA; D-Methylmalonyl-CoA

GSMNC0830504 C06002 Null mmalsa-S C4H6O3 Null Null 102.0317 Null MMSA

(S)-Methylmalonate semialdehyde

GSMNC0830505 C00392 MANNITOLmnl C6H14O6 C6H14O6 0 182.079 69-65-8 MNT

D-Mannitol

GSMNC0830506 C05659 Null Null C11H14N2O Null Null MOT

190.1106 608-07-1 5-Methoxytryptamine; 5-MeOT

GSMNC0830507 C04327 THZ-P 4mpetz C6H10NO4PS C6H8NO4PS -2 223.0068 Null MPET

4-Methyl-5-(2-phosphoethyl)-thiazole; 4-Methyl-5-(2-phosphono-oxyethyl)-thiazole

GSMNC0830508 C00957 mercppyr

3-MERCAPTO-PYRUVATE C3H4O3S C3H3O3S -1 MPYR

119.9881 2464-23-5 Mercaptopyruvate

GSMNC0830509 C05689 Null Null C4H9NO2Se Null Null 182.9799 Null MSCYS

Se-Methylselenocysteine

GSMNC0830510 C00546 mthgxl

METHYL-GLYOXAL C3H4O2 C3H4O2 0 72.0211 78-98-8 MTG

Methylglyoxal

GSMNC0830511 C00440 5mthf

5-METHYL-THF C20H25N7O6 C20H24N7O6 -1 MTHF

459.1866 134-35-0 5-Methyltetrahydrofolate

GSMNC0830512 C02442 CPD-391 Null C9H13NO Null Null MTRM

151.0997 370-98-9 N-Methyltyramine

GSMNC0830513 C00552 tartr-M

MESO-TARTRATE C4H6O6 Null Null MTTA

150.0164 147-73-9 meso-Tartaric acid; meso-Tartrate

GSMNC0830514 C04079 CPD-46 Null C12H22N2O6S Null Null 322.1199 Null N(P)CYS

N-((R)-Pantothenoyl)-L-cysteine

GSMNC0830515 C04778 5prdmbz

ALPHA-RIBAZOLE-5-P C14H19N2O7P C14H17N2O7P -2 N1(5PADR)DMB

358.093 975-91-7 N1-(5-Phospho-alpha-D-ribosyl)-5,6-dimethylbenzimidazole

GSMNC0830516 C03296 CPD-421 sucarg C10H18N4O5 C10H17N4O5 -1 274.1277 1758-80-1 N2SUCCARG

N2-Succinyl-L-arginine

GSMNC0830517 C05931 sucglu C9H13NO7

N2-SUCCINYLGLUTAMATE C9H10NO7 -3 247.0692 33981-72-5 N2SUCCGLU

N-Succinyl-L-glutamate; (2S)-2-(3-Carboxypropanoylamino)pentanedioic acid

GSMNC0830518 C05932 CPD-822 sucgsa C9H13NO6 C9H11NO6 -2 231.0743 Null N2SUCCGLU5SA

N-Succinyl-L-glutamate 5-semialdehyde; (2S)-2-(3-Carboxypropanoylamino)-5-oxopentanoic acid

GSMNC0830519 C05936 CPD-30 Null C6H11NO2 Null Null 129.079 Null N4AAB

N4-Acetylaminobutanal

GSMNC0830520 C01330 NA+ na1 Na Na 1 22.9898 7440-23-5 Sodium Na

GSMNC0830521 C00857 dnad

DEAMIDO-NAD C21H27N6O15P2 C21H24N6O15P2-2 665.101 Null NAAD

Deamino-NAD+; Deamido-NAD+; Deamido-NAD

GSMNC0830522 C00253 NIACINEnac C6H5NO2 C6H4NO2 -1 123.032 59-67-6 NicotinateNAC

GSMNC0830523 C05841 CPD-8259nicrns C11H14NO6 C11H13NO6 0 256.0821 Null NACD

Nicotinate D-ribonucleoside

GSMNC0830524 C01185 nicrnt C11H15NO9P

NICOTINATE_NUCLEOTIDE C11H12NO9P -2 336.0484 Null NACN

Nicotinate D-ribonucleotide

GSMNC0830525 C00003 NAD nad C21H28N7O14P2 C21H26N7O14P2-1 664.1169 53-84-9 NAD

NAD+; Nicotinamide adenine dinucleotide

GSMNC0830526 C00004 NADH nadh C21H29N7O14P2 C21H27N7O14P2-2 665.1248 58-68-4 NADH NADH

GSMNC0830527 C00645 acmana C8H15NO6

N-ACETYL-D-MANNOSAMINE C8H15NO6 0 221.0899 3615-17-6 NADMA

N-Acetyl-D-mannosamine

GSMNC0830528 C00006 NADP nadp C21H29N7O17P3 C21H25N7O17P3-3 744.0833 53-59-8 NADP+;NADPNicotinamide adenine dinucleotide phosphate

GSMNC0830529 C00005 NADPH nadph C21H30N7O17P3 C21H26N7O17P3-4 745.0911 2646-71-1 NADPHNADPH

GSMNC0830530 C00140 acgam C8H15NO6

N-ACETYL-D-GLUCOSAMINE C8H15NO6 0 221.0899 7512-17-6 NAGA

N-Acetyl-D-glucosamine

GSMNC0830531 C04256 acgam1p C8H16NO9P

N-ACETYL-D-GLUCOSAMINE-1-P C8H14NO9P -2 301.0563 Null NAGA1P

N-Acetyl-D-glucosamine 1-phosphate

GSMNC0830532 C00624 acglu

ACETYL-GLU C7H11NO5 C7H9NO5 -2 189.0637 1188-37-0 NAGLU

N-Acetyl-L-glutamate

GSMNC0830533 C04133 acg5p C7H12NO8P

N-ACETYL-GLUTAMYL-P C7H9NO8P -3 269.0301 Null NAGLUP

N-Acetyl-L-glutamate 5-phosphate

GSMNC0830534 C01250 CPD-469 acg5sa C7H11NO4 C7H10NO4 -1 173.0688 Null NAGLUS

N-Acetyl-L-glutamate 5-semialdehyde

GSMNC0830535 C00153 ncam

NIACINAMIDE C6H6N2O C6H6N2O 0 122.048 98-92-0 NAM

Nicotinamide

GSMNC0830536 C03150 CPD-7230rnam C11H15N2O5 C11H15N2O5 1 255.0981 1341-23-7 NAMD

N-Ribosylnicotinamide

GSMNC0830537 C00455 nmn

NICOTINAMIDE_NUCLEOTIDE

C11H15N2O8P C11H14N2O8P -1 334.0566 1094-61-7 NAMN

Nicotinamide D-ribonucleotide

GSMNC0830538 C00437 acorn C7H14N2O3

N-ALPHA-ACETYLORNITHINE C7H14N2O3 0 174.1004 6205-8-9 NAORN

N2-Acetyl-L-ornithine

GSMNC0830539 C00195 Null Null C19H36NO3R Null Null Null Null NAS

N-Acylsphingosine; Ceramide

GSMNC0830540 C05681 Null Null C21H42N2O5PR Null Null Null Null NASAEP

Ceramide 2-aminoethylphosphonate; Ceramide ciliatine

GSMNC0830541 C00439 forglu C6H10N2O4

N-FORMIMINO-L-GLUTAMATE C6H8N2O4 -2 174.0641 Null NFGLU

N-Formimino-L-glutamate

GSMNC0830542 C00014 AMMONIA nh4 NH3 Null Null 17.0265 7664-41-7 NH3 NH3

GSMNC0830543 C01028 CPD-265 Null C6H14N2O3 Null Null 162.1004 Null NHLYS

N6-Hydroxy-L-lysine

GSMNC0830544 C01152 Null Null C7H11N3O2 Null Null 169.0851 368-16-1 NMHIS

N(pi)-Methyl-L-Histidine

GSMNC0830545 C00088 NITRITE no2 HNO2 NO2 -1 47.0007 7697-37-2 Nitrite NO2

GSMNC0830546 C00244 NITRATE no3 HNO3 NO3 -1 62.9956 7697-37-2 Nitrate NO3

GSMNC0830547 C04302 pran C12H16NO9P

N-5-PHOSPHORIBOSYL-ANTHRANILATE

C12H13NO9P -3 349.0563 Null NPRAN

N-(5-Phospho-D-ribosyl)anthranilate

GSMNC0830548 C00007 o2

OXYGEN-MOLECULE O2 O2 0 31.9898 7782-44-7 Oxygen O2

GSMNC0830549 C00036 oaa

OXALACETIC_ACID C4H4O5 C4H2O5 -2 132.0059 328-42-7 OA

Oxaloacetate

GSMNC0830550 C01077 CPD-667 achms C6H11NO4 C6H11NO4 0 161.0688 Null OAHSER

O-Acetyl-L-homoserine

GSMNC0830551 C00109 2obut

2-OXOBUTANOATE C4H6O3 C4H5O3 -1 102.0317 600-18-0 OBUT

2-Oxobutanoate

GSMNC0830552 C00127 gthox

OXIDIZED-GLUTATHIONE

C20H32N6O12S2 C20H30N6O12S2-2 612.152 27025-41-8 OxidizedOGTglutathione; Glutathione disulfide; Oxiglutatione

GSMNC0830553 C06054 ohpb C4H7O8P

3OH-4P-OH-ALPHA-KETOBUTYRATEC4H4O8P -3 213.9879 Null OHB

3-Hydroxy-4-phospho-hydroxy-alpha-ketobutyrate

GSMNC0830554 C04236 CPD-71003c4mop C7H10O5 C7H8O5 -2 174.0528 Null OICAP

3-Carboxy-4-methyl-2-oxopentanoate

GSMNC0830555 C00141 3mob C5H8O3

2-KETO-ISOVALERATE C5H7O3 -1 116.0473 Null OIVAL

3-Methyl-2-oxobutanoic acid

GSMNC0830556 C01103 orot5p

OROTIDINE-5-PHOSPHATE

C10H13N2O11P C10H10N2O11P -3 368.0257 2149-82-8 OMP

Orotidine 5'-phosphate

GSMNC0830557 C04146 octdp C40H68O7P2

OCTAPRENYL-DIPHOSPHATE C40H65O7P2 -3 722.444 Null OPP

all-trans-Octaprenyl diphosphate

GSMNC0830558 C00435 Null Null Null Null Null Null Null rubredoxin

OxidizedORBRDX

GSMNC0830559 C00077 Null orn-L C5H12N2O2 Null Null 132.0899 70-26-8 ORN

L-Ornithine

GSMNC0830560 C00295 o

OROTATErot C5H4N2O4 C5H3N2O4 -1 156.0171 65-86-1 Orotate OROA

GSMNC0830561 C02730 sucbz

O-SUCCINYLBENZOATE C11H10O5 C11H8O5 -2 222.0528 Null OSB

O-succinylbenzoate

GSMNC0830562 C03160 CPD-6972sbzcoa C32H44N7O20P3SC32H39N7O20P3S

-5 971.1575 Null OSBCOA

O-succinylbenzoate-CoA

GSMNC0830563 C01118 suchms C8H13NO6

O-SUCCINYL-L-HOMOSERINE C8H12NO6 -1 219.0743 OSLHSER

1492-23-5 O-Succinyl-L-homoserine

GSMNC0830564 C00343 Null trdox C6H7NO2S2R2 X 0 Null Null OTHIO

Thioredoxin disulfide; Oxidized thioredoxin; Thioredoxin sulfide

GSMNC0830565 C03912 1pyr5c C5H7NO2

L-DELTA1-PYRROLINE_5-CARBOXYLATE C5H6NO2 -1 113.0477 Null P5C

(S)-1-Pyrroline-5-carboxylate

GSMNC0830566 C00627 pdx5p

PYRIDOXINE-5P C8H12NO6P C8H10NO6P -2 249.0402 P5P

447-05-2 Pyridoxine 5'-phosphate; Pyridoxine phosphate

GSMNC0830567 C00416 Null C5H7O8PR2

12dag3p;pa160 C35H67O8P -2 Null Null PA

Phosphatidate; 1,2-Diacyl-sn-glycerol 3-phosphate

GSMNC0830568 C02505 CPD-238 pad C8H9NO Null Null 135.0684 PAA

103-81-1 2-Phenylacetamide

GSMNC0830569 C00568 4abz

P-AMINO-BENZOATE C7H7NO2 C7H6NO2 -1 137.0477 PABA

150-13-0 4-Aminobenzoate

GSMNC0830570 C00601 pacald

PHENYLACETALDEHYDE C8H8O C8H8O 0 120.0575 PACAL

122-78-1 Phenylacetaldehyde; alpha-Tolualdehyde

GSMNC0830571 C05598 Null Null C10H11NO3 Null Null 193.0739 Null PACGLY

Phenylacetylglycine

GSMNC0830572 C00582 CPD-207 phaccoa C29H42N7O17P3SNull Null 885.1571 Null PACOA

Phenylacetyl-CoA

GSMNC0830573 C00522 pant-R

L-PANTOATE C6H12O4 C6H11O4 -1 148.0736 PANT

470-29-1 (R)-pantoate

GSMNC0830574 C00054 3-5-ADP pap C10H15N5O10P2 C10H11N5O10P2-4 427.0294 PAP

1053-73-2 Adenosine 3',5'-bisphosphate

GSMNC0830575 C00053 PAPS paps C10H15N5O13P2SNull Null 506.9862 PAPS

482-67-7 3'-Phosphoadenylyl sulfate

GSMNC0830576 C00931 ppbng

PORPHOBILINOGENC10H14N2O4 C10H13N2O4 -1 226.0954 PBG

487-90-1 Porphobilinogen

GSMNC0830577 C00157 Null Null C10H18NO8PR2 Null Null Null PC

8002-43-5 Phosphatidylcholine

GSMNC0830578 C02463 dscl;shcl C42H48N4O16 C42H41N4O16 -7;-8

DIHYDROSIROHYDROCHLORIN 864.3065 PC2

82542-92-5 Percorrin 2

GSMNC0830579 C00534 pydam

PYRIDOXAMINE C8H12N2O2 C8H13N2O2 1 168.0899 85-87-0 PDLA

Pyridoxamine

GSMNC0830580 C00647 pyam5p

PYRIDOXAMINE-5P C8H13N2O5P C8H12N2O5P -1 248.0562 PDLA5P

529-96-4 Pyridoxamine-5-phosphate

GSMNC0830581 C00350 Null psetha C7H12NO8PR2 Null Null Null Null PE

Phosphatidylethanolamine

GSMNC0830582 C05332 peamn

PHENYLETHYLAMINE C8H11N C8H12N 1 121.0891 64-04-0 PEA

Phenethylamine; 2-Phenylethylamine; beta-Phenylethylamine; Phenylethylamine

GSMNC0830583 C00074 pep C3H5O6P

PHOSPHO-ENOL-PYRUVATE C3H2O6P -3 167.9824 PEP

138-08-9 Phosphoenolpyruvate

GSMNC0830584 C00012 Null Null C2H4NO2R(C2H2NOR)n

Null Null Null Null Peptide PEPTIDE

GSMNC0830585 Null Null Null Null Null Null Null Null PEPTIDO

Peptidoglycan (biomass component)

GSMNC0830586 C00344 Null pgly C8H13O10PR2 Null Null Null Null PG

Phosphatidylglycerol

GSMNC0830587 C03892 Null pglyp;pgp160C8H14O13P2R2 C38H73O13P2 -3 Null Null PGP

Phosphatidylglycerophosphate

GSMNC0830588 C00079 PHE phe-L C9H11NO2 C9H11NO2 0 165.079 63-91-2 PHE

L-Phenylalanine

GSMNC0830589 C00254 pphn

PREPHENATE C10H10O6 C10H8O6 -2 226.0477 126-49-8 Prephenate PHEN

GSMNC0830590 C03511 Null phetrna C19H26NO11PR2(C5H8O6PR)n 1

C9H10NOR Null Null PHETRNAPHE

L-Phenylalanyl-tRNA(Phe)

GSMNC0830591 C00865 Null plipido C5H6O8PR3 Null Null Null Null PHOSPHOLIPID

Phospholipids (biomass component)

GSMNC0830592 C03232 3php

3-P-HYDROXYPYRUVATE C3H5O7P C3H2O7P -3 183.9773 Null PHP

3-Phosphonooxypyruvate

GSMNC0830593 C00166 phpyr

PHENYL-PYRUVATE C9H8O3 C9H7O3 -1 164.0473 PHPYR

156-06-9 Phenylpyruvate

GSMNC0830594 C01102 phom C4H10NO6P

O-PHOSPHO-L-HOMOSERINE C4H8NO6P -2 199.0246 Null PHSER

O-Phospho-L-homoserine

GSMNC0830595 C06055 phthr C4H10NO7P

4-PHOSPHONOOXY-THREONINE C4H8NO7P -2 215.0195 Null PHT

O-Phospho-4-hydroxy-L-threonine

GSMNC0830596 C00009 Pi pi H3PO4 HO4P -2 97.9769 Orthophosphate

14265-44-2;7664-38-2PI

GSMNC0830597 C00250 pydx

PYRIDOXAL C8H9NO3 C8H9NO3 0 167.0582 66-72-8 P

Pyridoxal L

GSMNC0830598 C00018 pydx5p

PYRIDOXAL_PHOSPHATE C8H10NO6P C8H8NO6P -2 247.0246 54-47-7 PL5P

Pyridoxal 5'-phosphate

GSMNC0830599 C07086 pac;pheac

PHENYLACETATE C8H8O2 C8H7O2 -1 136.0524 PLA

103-82-2 Phenylacetic acid; Benzylformic acid; Phenylacetate; Benzeneacetiic acid

GSMNC0830600 C00864 pnto-R

PANTOTHENATE C9H17NO5 C9H16NO5 -1 219.1107 79-83-4 PNTO

(R)-Pantothenate; Pantothenate

GSMNC0830601 C05983 Null Null C13H18N5O8P Null Null 403.0893 Null adenylate

Propinol PPA

GSMNC0830602 Null Null Null Null Null Null Null Null PPAACP

Propanoyl-[acyl-carrier protein]; Propionyl-[acyl-carrier protein]

GSMNC0830603 C03167 CPD-551 Null C2H5O4P Null Null 123.9925 Null PPAC

Phosphonoacetaldehyde

GSMNC0830604 C00100 ppcoa

PROPIONYL-COA C24H40N7O17P3SC24H36N7O17P3S -4 823.1414 PPACOA

317-66-8 Propanoyl-CoA; Propionyl-CoA

GSMNC0830605 C00894 Null

ACRYLYL-COA C24H38N7O17P3SNull Null 821.1258 Null PPCOA

Propenoyl-CoA; Acryloyl-CoA

GSMNC0830606 Null Null Null Null Null Null Null Null PPEPTIDO

Peptidoglycan precursor

GSMNC0830607 C01228 ppgpp

GUANOSINE-5DP-3DPC10H17N5O17P4 C10H11N5O17P4-6 602.957 Null ppGpp

Guanosine 3',5'-bis(diphosphate)

GSMNC0830608 C01079 pppg9 C34H40N4O4

PROTOPORPHYRINOGEN C34H38N4O4 -2 568.305 Null PPHG

Protoporphyrinogen IX

GSMNC0830609 C00013 PPI ppi P2H4O7 HO7P2 -3 177.9432 Pyrophosphate;

PPI

205513;206975;2466-9-3 Diphosphate

GSMNC0830610 C02191 ppp9

PROTOPORPHYRIN_IXC34H34N4O4 C34H32N4O4 -2 562.258 PPIX

553-12-8 Protoporphyrin IX

GSMNC0830611 C00804 CPD-661 Null C3H2O2 Null Null 70.0055 471-25-0 Propynoate PPN

GSMNC0830612 C04494 GDP-TP gdptp C10H18N5O20P5 C10H11N5O20P5-7 682.9233 Null pppGpp

Guanosine 3'-diphosphate 5'-triphosphate

GSMNC0830613 C00536 P3I pppi P3H5O10 HO10P3 -4 257.9096 Null PPPI

Triphosphate

GSMNC0830614 C04217 pendp C25H44O7P2

ALL-TRANS-PENTAPRENYL-DIPHOSPHATE

Null Null 518.2562 Null PPPP

all-trans-Pentaprenyl diphosphate

GSMNC0830615 C02059 Null C31H46O2

2-METHYL-3-PHYTYL-14-NAPHTHOQUINONE

Null Null 450.3498 84-80-0 PQ

Phylloquinone

GSMNC0830616 C00113 PQQ pqqox C14H6N2O8 Null Null 330.0124 PQQ

72909-34-3 Pyrrolo-quinoline quinone; Pyrroloquinoline-quinone; Pyrroloquinoline quinone; 4,5-Dioxo-4,5-dihydro-1H-pyrr

GSMNC0830617 C01359 CPD-104 pqqrd C14H8N2O8 Null Null 332.0281 Null pyrroloquinoline-quinone

ReducedPQQH2

GSMNC0830618 C03090 pram C5H12NO7P

5-P-BETA-D-RIBOSYL-AMINE C5H11NO7P -1 229.0351 Null PRAM

5-Phosphoribosylamine

GSMNC0830619 C02741 prbamp

PHOSPHORIBOSYL-AMP

C15H23N5O14P2 C15H19N5O14P2-4 559.0717 Null PRBAMP

N1-(5-Phospho-D-ribosyl)-AMP

GSMNC0830620 C02739 prbatp

PHOSPHORIBOSYL-ATP

C15H25N5O20P4 C15H19N5O20P4-6 719.0043 Null PRBATP

N1-(5-Phospho-D-ribosyl)-ATP

GSMNC0830621 C04734 fprica

PHOSPHORIBOSYL-FORMAMIDO-CARBOXAMIDE -2

C10H15N4O9P C10H13N4O9P 366.0577 Null PRFICA

1-(5'-Phosphoribosyl)-5-formamido-4-imidazolecarboxamide

GSMNC0830622 C04896 prfp

PHOSPHORIBOSYL-FORMIMINO-AICAR-P

C15H25N5O15P2 C15H21N5O15P2-4 577.0822 Null PRFP

5-(5-Phospho-D-ribosylaminoformimino)-1-(5-phosphoribosyl)-imidazole-4-carboxamide

GSMNC0830623 C04916 prlp

PHOSPHORIBULOSYL-FORMIMINO-AICAR-P

C15H25N5O15P2 C15H21N5O15P2-4 577.0822 Null PRLP

N-(5'-Phospho-D-1'-ribulosylformimino)-5-amino-1-(5"-phospho-D-ribosyl)-4-imidazolecarboxamide

GSMNC0830624 C00148 PRO pro-L C5H9NO2 C5H9NO2 0 115.0633 147-85-3 L-Proline PRO

GSMNC0830625 C00163 ppa

PROPIONATE C3H6O2 C3H5O2 -1 74.0368 79-09-4 PropanoatePROPANOATE

GSMNC0830626 C02876 ppap

PROPIONYL-P C3H7O5P C3H5O5P -2 154.0031 Null PROPIONYLP

Propanoyl phosphate

GSMNC0830627 C00017 Null protein C2H4NO2R(C2H2NOR)n

Null Null Null Null Proteins PROTEIN

GSMNC0830628 C02702 Null protrna C15H24NO11PR2(C5H8O6PR)n 1

C5H8NOR Null Null PROTRNAPRO

L-Prolyl-tRNA(Pro)

GSMNC0830629 C00119 PRPP prpp C5H13O14P3 C5H8O14P3 -5 389.9518 Null PRPP

5-Phospho-alpha-D-ribose 1-diphosphate

GSMNC0830630 C02737 Null ps C8H12NO10PR2 Null Null Null Null PS

Phosphatidylserine

GSMNC0830631 C00032 pheme

PROTOHEME C34H32FeN4O4 C34H30FeN4O4 -2 616.1773 PTH

14875-96-8 Heme; Haem; Protoheme; Heme B; Protoheme IX

GSMNC0830632 C00134 ptrc

PUTRESCINE C4H12N2 C4H14N2 2 88.1 110-60-1 Putrescine PTRC

GSMNC0830633 C00831 CPD-511 ptth C11H22N2O4S Null Null 278.13 496-65-1 Pantetheine PTT

GSMNC0830634 C01168 psd5p

PSEUDOURIDINE-5-PC9H13N2O9P Null Null 324.0359 PURI5P

1157-60-4 Pseudouridine 5'-phosphate

GSMNC0830635 C00022 PYRUVATEpyr C3H4O3 C3H3O3 -1 88.016 127-17-3 PyruvatePYR

GSMNC0830636 C00314 pydxn

PYRIDOXINE C8H11NO3 C8H11NO3 0 169.0739 65-23-6 PyridoxinePYRDX

GSMNC0830637 C03684 6pthp C9H11N5O3

6-PYRUVOYL-5678-TETRAHYDROPTERIN

C9H11N5O3 0 237.0862 Null PYTHP

6-Pyruvoyltetrahydropterin

GSMNC0830638 C03722 quln

QUINOLINATE C7H5NO4 C7H3NO4 -2 167.0219 89-00-9 QA

Quinolinate; Pyridine-2,3-dicarboxylate

GSMNC0830639 C00296 QUINATE Null C7H12O6 Null Null 192.0634 77-95-2 Quinic

Quinate; QNT acid; Kinic acid; Chinic acid; L-Quinic acid; L-Quinate; (-)-Quinic acid

GSMNC0830640 C00620 r1p

RIBOSE-1P C5H11O8P C5H9O8P -2 230.0192 R1P

58459-37-3 D-Ribose 1-phosphate; alpha-D-Ribose 1-phosphate; Ribose 1-phosphate

GSMNC0830641 C03561 CPD-650 3hbacoa C25H42N7O18P3SNull Null 853.152 Null R3HBCOA

(R)-3-Hydroxybutanoyl-CoA

GSMNC0830642 C00117 r5p

RIBOSE-5P C5H11O8P C5H9O8P -2 230.0192 R5P

4300-28-1 D-Ribose 5-phosphate

GSMNC0830643 C00071 Null Null CHOR Null Null Null Null R

Aldehyde CHO

GSMNC0830644 C00051 gthrd

GLUTATHIONE C10H17N3O6S C10H16N3O6S -1 307.0838 70-18-8 RGT

Glutathione

GSMNC0830645 C01371 Null Null HR Null Null Null Null Alkane RH

GSMNC0830646 C00255 ribflv

RIBOFLAVIN C17H20N4O6 C17H20N4O6 0 376.1383 83-88-5 RIBFLAV

Riboflavin

GSMNC0830647 C00199 ru5p-D

RIBULOSE-5P C5H11O8P C5H9O8P -2 230.0192 RL5P

4151-19-3 D-Ribulose 5-phosphate

GSMNC0830648 C00497 CPD-660 mal-D C4H6O5 C4H4O5 -2 134.0215 RMAL

636-61-3 (R)-Malate; D-Malate; D-Malic acid

GSMNC0830649 C00046 Null Null C10H18O13P2R2(C5H8O6PR)n

Null Null Null Null RNA RNA

GSMNC0830650 C00340 Null Null Null Null Null Null Null rubredoxin

ReducedRRBRDX

GSMNC0830651 C00342 Null trdrd C6H9NO2S2R2 XH2 0 Null RTHIO

52500-60-4 Thioredoxin

GSMNC0830652 C00087 HS s S S 0 31.9721 7704-34-9 Sulfur S

GSMNC0830653 C01096 sbt6p

D-SORBITOL-6-P C6H15O9P C6H13O9P -2 262.0454 S6P

108392-12-7Sorbitol 6-phosphate

GSMNC0830654 C05382 s7p C7H15O10P

D-SEDOHEPTULOSE-7-P C7H13O10P -2 290.0403 Null S7P

Sedoheptulose 7-phosphate

GSMNC0830655 C00021 ahcys

ADENOSYL-HOMO-CYSC14H20N6O5S C14H20N6O5S 0 384.1216 SAH

979-92-0 S-Adenosyl-L-homocysteine

GSMNC0830656 C04823 25aics C13H19N4O12P C13H15N4O12P -4

P-RIBOSYL-4-SUCCCARB-AMINOIMIDAZOLE 454.0737 SAICAR

3031-95-6 1-(5'-Phosphoribosyl)-5-amino-4-(N-succinocarboxamide)-imidazole

GSMNC0830657 C00019 amet C15H22N6O5S C15H23N6O5S 1

S-ADENOSYLMETHIONINE 398.1372 SAM

29908-03-0 S-Adenosyl-L-methionine

GSMNC0830658 C04425 amob

S-ADENOSYL-4-METHYLTHIO-2-OXOBUTANOATE 0

C15H20N5O6S C15H19N5O6S 398.1134 Null SAMOB

S-adenosyl-4-methylthio-2-oxobutanoate

GSMNC0830659 C04462 sl2a6o C11H15NO8

N-SUCCINYL-2-AMINO-6-KETOPIMELATE

C11H12NO8 -3 289.0798 Null SAOPIM

N-Succinyl-2-amino-6-oxopimelate

GSMNC0830660 C05692 Null Null C14H20N6O5Se Null Null 432.066 Null SASHCYS

Se-Adenosylselenohomocysteine

GSMNC0830661 C02888 CPD-531 srb1p C6H13O9P Null Null 260.0297 Null SB1P

Sorbose 1-phosphate

GSMNC0830662 C00213 Null

SARCOSINE C3H7NO2 Null Null 89.0477 SCSN

107-97-1 Sarcosine; N-Methylglycine

GSMNC0830663 C05688 Null Null C3H7NO2Se Null Null 168.9642 Null SCYS

Selenocysteine

GSMNC0830664 C04421 sl26da C11H18N2O7

N-SUCCINYLLL-2-6-DIAMINOPIMELATE

C11H16N2O7 -2 290.1114 Null SDAPIM

N-Succinyl-L-2,6-diaminopimelate

GSMNC0830665 C01169 CPD0-341sdhlam C12H21NO4S2 Null Null 307.0912 Null SDLIPO

S-Succinyldihydrolipoamide

GSMNC0830666 C05691 Null Null C15H23N6O5Se Null Null 447.0895 Null SeASMET

Se-Adenosylselenomethionine

GSMNC0830667 C01528 CPD-678 seln H2Se HSe -1 81.9322 531-44-2 SelenideSELD

GSMNC0830668 C05697 SELENATENull H2SeO4 Null Null 145.9118 7783-8-6 Selenate SELNT

GSMNC0830669 C05684 N

SELENITE ull SeO3 Null Null 127.9013 Null Selenite SELT

GSMNC0830670 C00065 SER ser-L C3H7NO3 C3H7NO3 0 105.0426 56-45-1 L-SerineSER

GSMNC0830671 C02553 Null sertrna C13H22NO12PR2(C5H8O6PR)n 1

C3H6NO2R Null Null SERTRNASER

L-Seryl-tRNA(Ser)

GSMNC0830672 C06157 Null Null C13H22NO4S2R Null Null Null Null SGDHL

S-Glutaryldihydrolipoamide

GSMNC0830673 C05817 2shchc C11H12O6

SUCCINYL-OH-CYCLOHEXADIENE-COOHC11H10O6 -2 240.0634 Null SHCHC

2-succinyl-6-hydroxy-2,4-cyclohexadiene-1-carboxylate

GSMNC0830674 C05778 scl

SIROHYDROCHLORIN C42H46N4O16 C42H39N4O16 -7 862.2909 SHCL

65207-12-7 Sirohydrochlorin

GSMNC0830675 C05698 Null C4H9NO2Se

SELENOHOMOCYSTEINE Null Null 182.9799 Null SHCYS

Selenohomocysteine

GSMNC0830676 C00748 SIROHEMEsheme C42H44FeN4O16 C42H36FeN4O16-8 916.2102 Null Siroheme SHEME

GSMNC0830677 C00186 lac-L

L-LACTATE C3H6O3 C3H5O3 -1 90.0317 79-33-4 SLAC

(S)-Lactate

GSMNC0830678 C00059 SULFATE so4 H2SO4 O4S -2 97.9674 7664-93-9 Sulfate SLF

GSMNC0830679 C05699 Null Null C7H14N2O4Se Null Null 270.0119 Null SLLCT

Selenocystathionine

GSMNC0830680 C00493 skm

SHIKIMATE C7H10O5 C7H9O5 -1 174.0528 138-59-0 Shikimate SME

GSMNC0830681 C03175 skm5p

SHIKIMATE-5P C7H11O8P C7H8O8P -3 254.0192 Null SME3P

Shikimate 3-phosphate

GSMNC0830682 C05335 Null

SELENOMETHIONINE C5H11NO2Se Null Null 196.9955 SMET

1464-42-2 Selenomethionine

GSMNC0830683 C05336 Null Null C20H30N6O11PSeR(C5H8O6PR)n Null

Null Null Null SMETTRNAMET

Selenomethionyl-tRNA(Met)

GSMNC0830684 C03415 sucorn C9H16N2O5

N2-SUCCINYLORNITHINE C9H15N2O5 -1 232.1059 SORN

80102-04-1 N2-Succinyl-L-ornithine; (2S)-5-Amino-2-(3-carboxypropanoylamino)pentanoic acid

GSMNC0830685 C00315 spmd

SPERMIDINE C7H19N3 C7H22N3 3 145.1579 124-20-9 Spermidine SPRMD

GSMNC0830686 C03539 CPD-564 rhcys C9H17NO6S C9H17NO6S 0 267.0777 SRLH

37558-16-0 S-Ribosyl-L-homocysteine

GSMNC0830687 C05824 Null

SULFO-CYSTEINE C3H7NO5S2 Null Null 200.9766 SSLCYS

1637-71-4 S-Sulfo-L-cysteine

GSMNC0830688 C00089 SUCROSEsucr C12H22O11 C12H22O11 0 342.1162 57-50-1 Sucrose SUC

GSMNC0830689 C00042 SUC succ C4H6O4 C4H4O4 -2 118.0266 S

110-15-6 Succinate UCC

GSMNC0830690 C00091 SUC-COAsuccoa C25H40N7O19P3SC25H35N7O19P3S

-5 867.1313 SUCCOA

604-98-8 Succinyl-CoA

GSMNC0830691 C00232 sucsal

SUCC-S-ALD C4H6O3 C4H5O3 -1 102.0317 SUCCSA

692-29-5 Succinate semialdehyde

GSMNC0830692 C00577 glyald

GLYCERALD C3H6O3 C3H6O3 0 90.0317 D-Glyceraldehyde

453-17-8 367-47-5 T3

GSMNC0830693 C01962 Null

THIOCYSTEINE C3H7NO2S2 Null Null 152.9918 TCYS

5652-32-4 Thiocysteine

GSMNC0830694 C03972 thdp C7H9NO4

DELTA1-PIPERIDEINE-2-6-DICARBOXYLATE

C7H7NO4 -2 171.0532 Null TDHDP

2,3,4,5-Tetrahydrodipicolinate

GSMNC0830695 C00422 Null Null C6H5O6R3 Null Null Null Null TGL

Triacylglycerol

GSMNC0830696 C04144 Null

CPD-1301 C29H37N9O12 C24H32N8O12 -2 703.2562 Null TGLU

Tetrahydropteroyltri-L-glutamate

GSMNC0830697 C00101 THF thf C19H23N7O6 C19H21N7O6 -2 445.171 THF

135-16-0 Tetrahydrofolate

GSMNC0830698 C03541 Null Null C19H23N7O6(C5H7NO3)n

Null Null Null Null THFG

Tetrahydrofolyl-[Glu](n)

GSMNC0830699 C00378 thm

THIAMINE C12H17N4OS C12H17N4OS 1 265.1123 Thiamin THIAMIN

23077;59-43-8

GSMNC0830700 C01081 thmmp

THIAMINE-P C12H18N4O4PS C12H16N4O4PS -1 345.0786 monophosphate

532-40-1 Thiamin THMP

GSMNC0830701 C00068 thmpp C12H19N4O7P2S C12H16N4O7P2S-2

THIAMINE-PYROPHOSPHATE 425.045 diphosphate

154-87-0 Thiamin THMPP

GSMNC0830702 C00188 THR thr-L C4H9NO3 C4H9NO3 0 119.0582 72-19-5 THR

L-Threonine

GSMNC0830703 C02992 Null thrtrna C14H24NO12PR2(C5H8O6PR)n 1

C4H8NO2R Null Null THRTRNATHR

L-Threonyl-tRNA(Thr)

GSMNC0830704 C04294 THZ 4mhetz C6H9NOS C6H9NOS 0 143.0405 THZ

137-00-8 5-(2-Hydroxyethyl)-4-methylthiazole; 4-Methyl-5-(2'-hydroxyethyl)-thiazole; 4-Methyl-5-(2-hydroxyethyl)-thiazo

GSMNC0830705 C04327 THZ-P 4mpetz C6H10NO4PS C6H8NO4PS -2 223.0068 Null THZP

4-Methyl-5-(beta-hydroxyethyl)thiazole phosphate

GSMNC0830706 C00178 THYMINEthym C5H6N2O2 C5H6N2O2 0 126.0429 65-71-4 ThymineTM

GSMNC0830707 C00245 TAURINEtaur C2H7NO3S C2H7NO3S 0 125.0147 107-35-7 Taurine TR

GSMNC0830708 C01083 tre

TREHALOSE C12H22O11 C12H22O11 0 342.1162 99-20-7 TRE

alpha,alpha-Trehalose

GSMNC0830709 C00689 tre6p

TREHALOSE-6P C12H23O14P C12H21O14P -2 422.0825 TRE6P

4484-88-2 alpha,alpha'-Trehalose 6-phosphate

GSMNC0830710 C00483 tym

TYRAMINE C8H11NO C8H12NO 1 137.0841 51-67-2 TRM

Tyramine; 2-(p-Hydroxyphenyl)ethylamine

GSMNC0830711 C01635 Null trnaala C10H17O10PR2(C5H8O6PR)n

R 0 Null Null tRNA(Ala)TRNAALA

GSMNC0830712 C01636 Null trnaarg C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Arg)TRNAARG

GSMNC0830713 C01638 Null trnaasp C10H17O10PR2(C5H8O6PR)n

R 0 Null Null tRNA(Asp)TRNAASP

GSMNC0830714 C01639 Null trnacys C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Cys)TRNACYS

GSMNC0830715 C01640 Null trnagln C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Gln)TRNAGLN

GSMNC0830716 C01641 Null trnaglu C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Glu)TRNAGLU

GSMNC0830717 C01642 Null trnagly C10H17O10PR2(C5H8O6PR)n

R 0 Null Null tRNA(Gly)TRNAGLY

GSMNC0830718 C01643 Null trnahis C10H17O10PR2(C5H8O6PR)n

R 0 Null Null tRNA(His)TRNAHIS

GSMNC0830719 C01644 Null trnaile C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Ile)TRNAILE

GSMNC0830720 C01645 Null trnaleu C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Leu)TRNALEU

GSMNC0830721 C01646 Null trnalys C10H17O10PR2(C5H8O6PR)n

R 0 Null Null tRNA(Lys)TRNALYS

GSMNC0830722 C01647 Null trnamet C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Met)TRNAMET

GSMNC0830723 C01648 Null trnaphe C10H17O10PR2(C5H8O6PR)n

R 0 Null Null tRNA(Phe)TRNAPHE

GSMNC0830724 C01649 Null trnapro C10H17O10PR2(C5H8O6PR)n

R 0 Null Null tRNA(Pro)TRNAPRO

GSMNC0830725 C01650 Null trnaser C10H17O10PR2(C5H8O6PR)n

R 0 Null Null tRNA(Ser)TRNASER

GSMNC0830726 C01651 Null trnathr C10H17O10PR2(C5H8O6PR)n

R 0 Null Null tRNA(Thr)TRNATHR

GSMNC0830727 C01652 Null trnatrp C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Trp)TRNATRP

GSMNC0830728 C00787 Null trnatyr C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Tyr)TRNATYR

GSMNC0830729 C01653 Null trnaval C15H21N5O10PR(C5H8O6PR)n 0

R Null Null tRNA(Val)TRNAVAL

GSMNC0830730 C00078 TRP trp-L C11H12N2O2 C11H12N2O2 0 204.0899 73-22-3 TRP

L-Tryptophan

GSMNC0830731 C03512 Null trptrna C26H31N7O11PR(C5H8O6PR)n 1

C11H11N2OR Null Null TRPTRNATRP

L-Tryptophanyl-tRNA(Trp)

GSMNC0830732 C02839 Null tyrtrna C24H30N6O12PR(C5H8O6PR)n 1

C9H10NO2R Null Null TRYTRNATYR

L-Tyrosyl-tRNA(Tyr)

GSMNC0830733 C00898 TARTRATEtartr-L C4H6O6 C4H4O6 -2 150.0164 87-69-4 TTA

(R,R)-Tartaric acid; (R,R)-Tartrate; L-Tartaric acid; Tartaric acid; Tartrate; 2,3-Dihydroxybutanedioic acid; (2R,3

GSMNC0830734 C00082 TYR tyr-L C9H11NO3 C9H11NO3 0 181.0739 60-18-4 TYR

L-Tyrosine

GSMNC0830735 C01010 CPD-578 Null C2H4N2O3 Null Null 104.0222 Null U1C

Urea-1-carboxylate; Allophanate; Allophanic acid

GSMNC0830736 C00785 Null

UROCANATE C6H6N2O2 Null Null 138.0429 104-98-3 UrocanateUC

GSMNC0830737 C00348 udcpp

UNDECAPRENYL-P C55H91O4P C55H89O4P -2 846.6655 Null UDCP

Undecaprenyl phosphate

GSMNC0830738 C04574 udcpdp C55H92O7P2

UNDECAPRENYL-DIPHOSPHATE C55H89O7P2 -3 926.6318 Null UDCPP

Undecaprenyl diphosphate

GSMNC0830739 C00603 CPD-1091urdglyc C3H6N2O4 C3H5N2O4 -1 134.0328 Null UDGLYCOLATE

(-)-Ureidoglycolate; (S)-Ureidoglycolate

GSMNC0830740 C00015 UDP udp C9H14N2O12P2 C9H11N2O12P2 -3 404.0022 58-98-0 UDP UDP

GSMNC0830741 C00203 udpacgal C17H27N3O17P2

UDP-N-ACETYL-GALACTOSAMINE C17H25N3O17P2-2 607.0816 Null UDPAGLACA

UDP-N-acetyl-D-galactosamine

GSMNC0830742 C00029 udpg

UDP-GLUCOSE C15H24N2O17P2 C15H22N2O17P2-2 566.055 133-89-1 UDPG

UDP-glucose

GSMNC0830743 C04652 u23ga

OH-MYRISTOYL C43H77N3O20P2 C43H75N3O20P2-2 1017.4576 Null UDPG23A

UDP-2,3-bis(3-hydroxytetradecanoyl)glucosamine

GSMNC0830744 C06022 u3hga C29H51N3O18P2 C29H50N3O18P2-1

UDP-OHMYR-GLUCOSAMINE 791.2643 Null UDPG2A

UDP-3-O-(3-hydroxytetradecanoyl)glucosamine

GSMNC0830745 C04738 u3aga C31H53N3O19P2 C31H51N3O19P2-2

UDP-OHMYR-ACETYLGLUCOSAMINE 833.2749 Null UDPG2AA

UDP-3-O-(3-hydroxytetradecanoyl)-N-acetylglucosamine

GSMNC0830746 C00052 udpgal

UDP-GALACTOSE C15H24N2O17P2 C15H22N2O17P2-2 566.055 2956-16-3 UDPGAL

UDP-D-galactose

GSMNC0830747 C00167 udpglcur

UDP-GLUCURONATE C15H22N2O18P2 C15H19N2O18P2-3 580.0343 Null UDPGLUC

UDP-glucuronate

GSMNC0830748 C04877 ugmd C35H55N7O26P2 C35H51N7O26P2-4

UDP-AAGM-DIAMINOHEPTANEDIOATE 1051.2672 Null UDPMNLADGMD

UDP-N-acetylmuramoyl-L-alanyl-D-gamma-glutamyl-meso-2,6-diaminopimelate

GSMNC0830749 C04882 C1 ugmda C41H65N9O28P2 C41H61N9O28P2-4 1193.3414 Null UDPMNLADGMDDADA

UDP-N-acetylmuramoyl-L-alanyl-D-glutamyl-6-carboxy-L-lysyl-D-alanyl-D-alanine

GSMNC0830750 C01170 uacmam

UDP-MANNAC C17H27N3O17P2 C17H25N3O17P2-2 607.0816 Null UDPNADMA

UDP-N-acetyl-D-mannosamine

GSMNC0830751 C06240 Null uacmamu C17H25N3O18P2 C17H22N3O18P2-3 621.0608 Null UDPNADMAU

UDP-N-acetyl-D-mannosaminouronate

GSMNC0830752 C00043 uacgam C17H27N3O17P2

UDP-N-ACETYL-D-GLUCOSAMINE C17H25N3O17P2-2 607.0816 Null UDPNAG

UDP-N-acetyl-D-glucosamine

GSMNC0830753 C04631 uaccg C20H29N3O19P2 C20H26N3O19P2-3

UDP-ACETYL-CARBOXYVINYL-GLUCOSAMINE 677.087 70222-94-5 UDPNAGEP

UDP-N-acetyl-3-(1-carboxyvinyl)-D-glucosamine

GSMNC0830754 C01050 uamr C20H31N3O19P2 C20H28N3O19P2-3

UDP-N-ACETYLMURAMATE 679.1027 Null UDPNAM

UDP-N-acetylmuramate

GSMNC0830755 C01212 uama C23H36N4O20P2 C23H33N4O20P2-3

UDP-ACETYLMURAMOYL-ALA 750.1398 Null UDPNAMA

UDP-N-acetylmuramoyl-L-alanine

GSMNC0830756 C00692 uamag

UDP-AA-GLUTAMATE C28H43N5O23P2 C28H39N5O23P2-4 879.1824 Null UDPNAMAG

UDP-N-acetylmuramoyl-L-alanyl-D-glutamate

GSMNC0830757 C00105 UMP ump C9H13N2O9P C9H11N2O9P -2 324.0359 58-97-9 UMP UMP

GSMNC0830758 C05898 C6 uaagmda C95H156N8O28P2C95H152N8O28P2

-4 1919.0504 Null UPPMN(GN)LADGMDDADA

Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutamyl-meso-2,6-diaminopime

GSMNC0830759 Null Null Null Null Null Null Null Null UPPMN(GN)LADGNMD(G)5DA

Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutaminyl-meso-2,6-diaminopim

GSMNC0830760 Null Null Null Null Null Null Null Null UPPMN(GN)LADGNMDDADA

Undecaprenyl-diphospho-N-acetylmuramoyl-(N-acetylglucosamine)-L-alanyl-D-glutaminyl-meso-2,6-diaminopim

GSMNC0830761 C05897 Null uagmda C87H143N7O23P2C87H139N7O23P2

-4 1715.9711 Null UPPMNLADGMDDADA

Undecaprenyl-diphospho-N-acetylmuramoyl-L-alanyl-D-glutamyl-meso-2,6-diaminopimeloyl-D-alanyl-D-alanine

GSMNC0830762 C01051 uppg3 C40H44N4O16 C40H36N4O16 -8

UROPORPHYRINOGEN-III 836.2752 1976-85-8 UPRG

Uroporphyrinogen III

GSMNC0830763 C05766 Null

CPD-11444 C40H44N4O16 Null Null 836.2752 1867-62-5 UPRGI

Uroporphyrinogen I

GSMNC0830764 C00399 q8

UBIQUINONE-2;UBIQUINONE-8

C14H18O4(C5H8)n 14H18O4

C 0 Null 1339-63-5 UQ

Ubiquinone

GSMNC0830765 C00390 q8h2

CPD-9956;QH2;UBIQUINOL-30

C14H20O4(C5H8)n 14H20O4

C 0 Null 56275-39-9 UbiquinolUQH2

GSMNC0830766 C00106 URACIL ura C4H4N2O2 C4H4N2O2 0 112.0273 66-22-8 Uracil URA

GSMNC0830767 C00086 UREA urea CH4N2O CH4N2O 0 60.0324 57-13-6 Urea UREA

GSMNC0830768 C00299 URIDINEuri C9H12N2O6 C9H12N2O6 0 244.0695 58-96-8 Uridine URI

GSMNC0830769 C00366 URATE urate C5H4N4O3 C5H4N4O3 0 168.0283 69-93-2 URT

Urate; Uric acid

GSMNC0830770 C00075 UTP utp C9H15N2O15P3 C9H11N2O15P3 -4 483.9685 63-39-8 UTP UTP

GSMNC0830771 C00183 VAL val-L C5H11NO2 C5H11NO2 0 117.079 72-18-4 L-ValineVAL

GSMNC0830772 C02554 Null valtrna C20H30N6O11PR(C5H8O6PR)n 1

C5H10NOR Null Null VALTRNAVAL

L-Valyl-tRNA(Val)

GSMNC0830773 C05776 Null Null C62H88CoN13O14PR

Null Null Null Null B12

Vitamin VB12

GSMNC0830774 C00231 xu5p-D C5H11O8P

XYLULOSE-5-PHOSPHATE C5H9O8P -2 230.0192 Null X5P

D-Xylulose 5-phosphate

GSMNC0830775 C00385 xan

XANTHINE C5H4N4O2 C5H4N4O2 0 152.0334 69-89-6 XanthineXAN

GSMNC0830776 C00655 xmp C10H13N4O9P

XANTHOSINE-5-PHOSPHATE C10H11N4O9P -2 364.042 523-98-8 XMP

Xanthosine 5'-phosphate

GSMNC0830777 C00700 XTP xtp C10H15N4O15P3 C10H11N4O15P3-4 523.9747 Null XTP XTP

GSMNC0830778 C01762 xtsn

XANTHOSINE C10H12N4O6 C10H12N4O6 0 284.0757 146-80-5 XTSINE

Xanthosine