Metabolites

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Displaying metabolites 2951 - 2975 of 3755 in total
Metabolite ID Name
CAS Number		IUPAC NameSMPDB PathwaysWeight
Formula		Structure
ECMDB201075-Phenyl-1,3-oxazinane-2,4-dione

4-hydroxy-5-phenyl-5,6-dihydro-2H-1,3-oxazin-2-one
191.1834

C10H9NO3		Thumb
ECMDB201065-O-(1-Carboxyvinyl)-3-phosphoshikimate

89771-75-5		(3R,4S,5R)-5-[(1-carboxyeth-1-en-1-yl)oxy]-4-hydroxy-3-(phosphonooxy)cyclohex-1-ene-1-carboxylic acid
324.178

C10H13O10P		Thumb
ECMDB201055-Methylhex-4-enoyl-CoA

4-({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-hydroxy-3,3-dimethyl-N-[2-({2-[(5-methylhex-4-enoyl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)ethyl]butanimidic acid
877.688

C28H46N7O17P3S		Thumb
ECMDB201045-Methyl-3-oxo-4-hexenoyl-CoA

4-({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-2-hydroxy-3,3-dimethyl-N-[2-({2-[(5-methyl-3-oxohex-4-enoyl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)ethyl]butanimidic acid
891.671

C28H44N7O18P3S		Thumb
ECMDB201035-Dehydro-4-deoxy-D-glucuronate

(4S,5R)-4,5-dihydroxy-2,6-dioxohexanoic acid
Collection of Reactions without pathways PW001891
176.1241

C6H8O6		Thumb
ECMDB201025-Dehydro-4-deoxy-D-glucarate

(2R,3S)-2,3-dihydroxy-5-oxohexanedioic acid
192.1235

C6H8O7		Thumb
ECMDB201015-Carboxy-2-pentenoyl-CoA

138149-18-5		(4E)-6-({2-[(3-{[4-({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-1,2-dihydroxy-3,3-dimethylbutylidene]amino}-1-hydroxypropylidene)amino]ethyl}sulfanyl)-6-oxohex-4-enoic acid
Phenylalanine metabolism PW000921
893.644

C27H42N7O19P3S		Thumb
ECMDB200995-Amino-6-(5'-phosphoribosylamino)uracil

{[(2R,3S,4R,5R)-5-[(5-amino-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)amino]-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
Flavin biosynthesis PW001971
354.2106

C9H15N4O9P		Thumb
ECMDB200985-Amino-4-imidazolecarboxyamide

72-40-2		4-amino-1H-imidazole-5-carboxamide
Secondary Metabolites: Histidine biosynthesis PW000984
histidine biosynthesis PW000810
126.1166

C4H6N4O		Thumb
ECMDB200975-(2-Hydroxyethyl)-4-methylthiazole

137-00-8		2-(4-methyl-1,3-thiazol-5-yl)ethan-1-ol
143.207

C6H9NOS		Thumb
ECMDB200964,5-Dihydro-4-hydroxy-5-S-glutathionyl-benzo[a]pyrene

(2S)-2-amino-4-{[(1R)-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]-2-({11-hydroxypentacyclo[10.6.2.0²,⁷.0⁹,¹⁹.0¹⁶,²⁰]icosa-1(19),2,4,6,8,12,14,16(20),17-nonaen-10-yl}sulfanyl)ethyl]-C-hydroxycarbonimidoyl}butanoic acid
Collection of Reactions without pathways PW001891
glutathione metabolism III PW002018
575.632

C30H29N3O7S		Thumb
ECMDB200954-Phospho-D-erythronate

(2R,3R)-2,3-dihydroxy-4-(phosphonooxy)butanoic acid
Vitamin B6 1430936196 PW000891
216.0832

C4H9O8P		Thumb
ECMDB200944-Methyl-5-(2-phosphoethyl)-thiazole

[1-hydroxy-2-(4-methyl-1,3-thiazol-5-yl)ethyl]phosphonic acid
223.187

C6H10NO4PS		Thumb
ECMDB200934-Hydroxyphenylacetaldehyde

60-11-7		2-(4-hydroxyphenyl)acetaldehyde
136.1479

C8H8O2		Thumb
ECMDB200924-Hydroxy-L-threonine

21768-45-6		(2S,3S)-2-amino-3,4-dihydroxybutanoic acid
135.1186

C4H9NO4		Thumb
ECMDB200914-Hydroxy-5-phenyltetrahydro-1,3-oxazin-2-one

5-phenyl-5,6-dihydro-4H-1,3-oxazine-2,4-diol
193.1992

C10H11NO3		Thumb
ECMDB200904-Hydroxy-2-oxopentanoate

3318-73-8		4-hydroxy-2-oxopentanoic acid
Phenylalanine metabolism PW000921
2-Oxopent-4-enoate metabolism PW001890
2-Oxopent-4-enoate metabolism 2 PW002035
131.108

C5H7O4		Thumb
ECMDB200894-Hydroxy-2-oxohexanoic acid

4-hydroxy-2-oxohexanoic acid
Collection of Reactions without pathways PW001891
146.1412

C6H10O4		Thumb
ECMDB200884-Glutathionyl cyclophosphamide

2-amino-4-{[2-({2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2λ⁵-oxazaphosphinan-4-yl}sulfanyl)-1-[(carboxymethyl)-C-hydroxycarbonimidoyl]ethyl]-C-hydroxycarbonimidoyl}butanoic acid
566.394

C17H30Cl2N5O8PS		Thumb
ECMDB200874-Carboxy-4-hydroxy-2-oxoadipate

2-hydroxy-4-oxobutane-1,2,4-tricarboxylic acid
220.1336

C7H8O8		Thumb
ECMDB200864-Amino-5-hydroxymethyl-2-methylpyrimidine

73-67-6		(4-amino-2-methylpyrimidin-5-yl)methanol
139.1552

C6H9N3O		Thumb
ECMDB200854-Amino-4-deoxychorismate

133442-18-9		(3R,4R)-4-amino-3-[(1-carboxyeth-1-en-1-yl)oxy]cyclohexa-1,5-diene-1-carboxylic acid
Folate biosynthesis PW000908
224.193

C10H10NO5		Thumb
ECMDB200844-Amino-2-methyl-5-phosphomethylpyrimidine

[(6-imino-2-methyl-1,6-dihydropyrimidin-5-yl)methoxy]phosphonic acid
217.122

C6H8N3O4P		Thumb
ECMDB200834-(Cytidine 5'-diphospho)-2-C-methyl-D-erythritol

[({[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-hydroxy-4-imino-1,4-dihydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy][(2R,3S)-2,3,4-trihydroxy-3-methylbutoxy]phosphinic acid
Secondary metabolites: isoprenoid biosynthesis (nonmevalonate pathway) PW000975
Secondary metabolites: methylerythritol phosphate and polyisoprenoid biosynthesis PW000958
519.294

C14H23N3O14P2		Thumb
ECMDB200813'-UMP

35170-03-7		{[(2R,3S,4R,5R)-4-hydroxy-5-(4-hydroxy-2-oxo-1,2-dihydropyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy}phosphonic acid
Pyrimidine metabolism PW000942
Pyrimidine ribonucleosides degradtion PW002024
324.1813

C9H13N2O9P		Thumb
Displaying metabolites 2951 - 2975 of 3755 in total