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Displaying metabolites 2676 - 2700 of 3755 in total
Metabolite IDName
CAS Number
IUPAC NameSMPDB PathwaysWeight
Formula
Structure
ECMDB20010(3S)-3-Hydroxyadipyl-CoA

(4S)-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)-4-hydroxy-6-oxohexanoic acid
Phenylalanine metabolism PW000921
911.659

C27H44N7O20P3S
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ECMDB202313-Hydroxyadipyl-CoA

6-({2-[(3-{[4-({[({[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)-4-hydroxy-6-oxohexanoic acid
Phenylethylamine metabolism PW002027
911.659

C27H44N7O20P3S
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ECMDB20541D-Carnitinyl-CoA

[4-({2-[(3-{[4-({[({[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)-2-hydroxy-4-oxobutyl]trimethylazanium
L-carnitine degradation I PW002037
911.726

C28H50N8O18P3S
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ECMDB20578L-Carnitinyl-CoA

[4-({2-[(3-{[4-({[({[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)-2-hydroxy-4-oxobutyl]trimethylazanium
911.726

C28H50N8O18P3S
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ECMDB23341CDP-DG(14:0/15:0)

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({hydroxy[(2R)-2-(pentadecanoyloxy)-3-(tetradecanoyloxy)propoxy]phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis CDP-DG(14:0/15:0) PW001795
phospholipid biosynthesis CDP-DG(14:0/15:0) II PW001857
912.005

C41H75N3O15P2
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ECMDB23349CDP-DG(15:0/14:0)

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({hydroxy[(2R)-3-(pentadecanoyloxy)-2-(tetradecanoyloxy)propoxy]phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis CDP-DG(15:0/14:0) PW001807
912.005

C41H75N3O15P2
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ECMDB24730CDP-DG(19:iso/10:0)

{[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[(2R)-2-(decanoyloxy)-3-[(17-methyloctadecanoyl)oxy]propoxy](hydroxy)phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis (CL(19:iso/10:0/19:iso/10:0)) PW001998
912.005

C41H75N3O15P2
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ECMDB20120Benzoyl acetyl-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-[(3-oxo-3-phenylpropanoyl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)ethyl]butanimidic acid
913.677

C30H42N7O18P3S
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ECMDB24663CDP-DG(14:0(3-OH)/14:0)

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({hydroxy[(2R)-3-[(3-hydroxytetradecanoyl)oxy]-2-(tetradecanoyloxy)propoxy]phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis (CL(14:0(3-OH)/14:0/14:0/14:0)) PW001937
913.977

C40H73N3O16P2
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ECMDB24668CDP-DG(14:0/14:0(3-OH))

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({hydroxy[(2R)-2-[(3-hydroxytetradecanoyl)oxy]-3-(tetradecanoyloxy)propoxy]phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis (CL(14:0/14:0(3-OH)/14:0/14:0)) PW001944
913.977

C40H73N3O16P2
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ECMDB20194Siroheme

52553-42-1
3-[(4S,5S,9S,10S,11Z,16Z)-9,15,19-tris(2-carboxyethyl)-5,10,14,20-tetrakis(carboxymethyl)-5,10-dimethyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.1³,⁶.1¹³,¹⁶.0⁸,²³.0¹⁸,²¹]pentacosa-1(20),2,6(25),7,11,13(24),14,16,18-nonaen-4-yl]propanoic acid
Sulfur metabolism PW000922
Porphyrin metabolism PW000936
Flavin biosynthesis PW001971
916.661

C42H44FeN4O16
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ECMDB20611trans-Delta2, cis-delta4-decadienoyl-CoA

4-({[({[(2S,3S,4R,5S)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-N-(2-{[2-(deca-2,4-dienoylsulfanyl)ethyl]-C-hydroxycarbonimidoyl}ethyl)-2-hydroxy-3,3-dimethylbutanimidic acid
917.75

C31H50N7O17P3S
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ECMDB20261cis-dihydrodiol derivative of phenylacetyl-CoA

4-({[({[5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)-N-(2-{[2-({2-[(1R,6S)-1,6-dihydroxycyclohexa-2,4-dien-1-yl]acetyl}sulfanyl)ethyl]-C-hydroxycarbonimidoyl}ethyl)-2-hydroxy-3,3-dimethylbutanimidic acid
919.681

C29H44N7O19P3S
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ECMDB231583-Oxo-5,6-dehydrosuberyl-CoA semialdehyde

(2R)-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)-N-{2-[(2-{[(5Z)-3,8-dioxooct-5-enoyl]sulfanyl}ethyl)-C-hydroxycarbonimidoyl]ethyl}-2-hydroxy-3,3-dimethylbutanimidic acid
Phenylalanine metabolism PW000921
Collection of Reactions without pathways PW001891
Phenylethylamine metabolism PW002027
919.681

C29H44N7O19P3S
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ECMDB201087-Methyl-3-oxo-6-octenoyl-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-[(7-methyl-3-oxooct-6-enoyl)sulfanyl]ethyl}-C-hydroxycarbonimidoyl)ethyl]butanimidic acid
919.725

C30H48N7O18P3S
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ECMDB03948(2E)-Decenoyl-CoA

10018-95-8
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-{[({[(3-{[2-({2-[(2E)-dec-2-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
Fatty acid metabolism PW000796
Collection of Reactions without pathways PW001891
fatty acid oxidation (Decanoate) PW001018
919.768

C31H52N7O17P3S
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ECMDB06404Decanoyl-CoA (N-C10:0CoA)

1264-57-9
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-[({[({3-[(2-{[2-(decanoylsulfanyl)ethyl]carbamoyl}ethyl)carbamoyl]-3-hydroxy-2,2-dimethylpropoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)methyl]-4-hydroxyoxolan-3-yl]oxy}phosphonic acid
Fatty acid metabolism PW000796
fatty acid oxidation (Decanoate) PW001018
fatty acid oxidation (octanoate) PW001022
921.783

C31H54N7O17P3S
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ECMDB21249N-Acetyl-D-glucosamine(anhydrous)N-Acetylmuramyl-tetrapeptide

2-amino-6-{[4-carboxy-2-({2-[(2-{[(3R,4R)-2-{[(2S,3R,4R,5S,6R)-4,5-dihydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)oxan-2-yl]oxy}-4-[(1-hydroxyethylidene)amino]-6,8-dioxabicyclo[3.2.1]octan-3-yl]oxy}-1-hydroxypropylidene)amino]-1-hydroxypropylidene}amino)-1-hydroxybutylidene]amino}-6-[(1-carboxyethyl)-C-hydroxycarbonimidoyl]hexanoic acid
921.8993

C37H59N7O20
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ECMDB24679CDP-DG(15:0cyclo/15:0cyclo)

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[(2R)-2,3-bis({[8-(2-butylcyclopropyl)octanoyl]oxy})propoxy](hydroxy)phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis CL(15:0cyclo/15:0cyclo/14:0/16:0) PW001059
922.0

C42H73N3O15P2
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ECMDB23337CDP-DG(12:0/18:1(9Z))

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[(2R)-3-(dodecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propoxy](hydroxy)phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis CDP-DG(12:0/18:1(9Z)) PW001777
phospholipid biosynthesis CDP-DG(12:0/18:1(9Z)) II PW001843
924.016

C42H75N3O15P2
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ECMDB23343CDP-DG(14:0/16:1(9Z))

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[(2R)-2-[(9Z)-hexadec-9-enoyloxy]-3-(tetradecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis CL(16:0/14:0/14:0/16:1(9Z)) PW001206
924.016

C42H75N3O15P2
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ECMDB23364CDP-DG(16:1(9Z)/14:0)

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[(2R)-3-[(9Z)-hexadec-9-enoyloxy]-2-(tetradecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis CL(16:1(9Z)/14:0/16:1(9Z)/14:0) PW001419
924.016

C42H75N3O15P2
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ECMDB23377CDP-DG(18:1(9Z)/12:0)

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[(2R)-2-(dodecanoyloxy)-3-[(9Z)-octadec-9-enoyloxy]propoxy](hydroxy)phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis (PE(18:1(9Z)/12:0(3-OH))) PW001780
924.016

C42H75N3O15P2
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ECMDB24709CDP-DG(18:1(11Z)/12:0)

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[(2R)-2-(dodecanoyloxy)-3-[(11Z)-octadec-11-enoyloxy]propoxy](hydroxy)phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis (CL(18:1(11Z)/12:0/12:0/12:0)) PW001977
924.016

C42H75N3O15P2
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ECMDB24637CDP-DG(10:0(3-OH)/19:0cycv8c)

{[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}({[(2R)-2-{[10-(2-hexylcyclopropyl)decanoyl]oxy}-3-[(3-hydroxydecanoyl)oxy]propoxy](hydroxy)phosphoryl}oxy)phosphinic acid
phospholipid biosynthesis (CL(10:0(3-OH)/19:0cycv8c/10:0(3-OH)/19:0cycv8c)) PW001908
925.988

C41H73N3O16P2
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Displaying metabolites 2676 - 2700 of 3755 in total