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4-coumaroyl-CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM1364402Image of MNXM1364402
#reac
in my sandbox 0
in MNXref (generic)26
in models (compartimentalized) 5
formulaC30H38N7O18P3S
charge-4
mass909.644
referencechebi:57355
InChIKeyDMZOKBALNZWDKI-FUEUKBNZSA-J
InChIInChI=1S/C30H42N7O18P3S/c1-30(2,25(42)28(43)33-10-9-20(39)32-11-12-59-21(40)8-5-17-3-6-18(38)7-4-17)14-52-58(49,50)55-57(47,48)51-13-19-24(54-56(44,45)46)23(41)29(53-19)37-16-36-22-26(31)34-15-35-27(22)37/h3-8,15-16,19,23-25,29,38,41-42H,9-14H2,1-2H3,(H,32,39)(H,33,43)(H,47,48)(H,49,50)(H2,31,34,35)(H2,44,45,46)/p-4/t19-,23-,24-,25+,29-/m1/s1
SMILES[CH3:1][C:30]([CH3:2])([CH2:14][O:52][P:58]([OH:49])(=[O:50])[O:55][P:57]([OH:47])(=[O:48])[O:51][CH2:13][C@@H:19]1[C@@H:24]([O:54][P:56]([OH:44])([OH:45])=[O:46])[C@@H:23]([OH:41])[C@H:29]([n:37]2[cH:16][n:36][c:22]3[c:26]([NH2:31])[n:34][cH:15][n:35][c:27]32)[O:53]1)[C@H:25]([C:28](=[N:33][CH2:10][CH2:9][C:20](=[N:32][CH2:11][CH2:12][S:59][C:21]([CH:8]=[CH:5][c:17]1[cH:3][cH:6][c:18]([OH:38])[cH:7][cH:4]1)=[O:40])[OH:39])[OH:43])[OH:42]
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 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:57355
chebi:57355 		4-coumaroyl-CoA
3'-phosphonatoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] diphosphate}
4-coumaroyl-CoA(4-)
sabiork.compound:1982
sabiorkM:1982 		4-Coumaroyl-CoA
4-Hydroxycinnamoyl-CoA
p-Coumaroyl-CoA
vmhM:coucoa
vmhmetabolite:coucoa 		4-coumaroyl-CoA(4-)
4-[(1R)-2-amino-1-hydroxyethyl]benzene-1,2-diol
CHEBI:15499
chebi:15499 		4-coumaroyl-CoA
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
4-Coumaroyl-CoA
4-Coumaroyl-coa
4-Coumaroyl-coenzyme A
4-Hydroxycinnamoyl-CoA
lipidmaps:LMFA07050265
lipidmapsM:LMFA07050265 		4-coumaroyl-CoA
3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-({3-[(2-{[3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl}ethyl)amino]-3-oxopropyl}amino)-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}
4-Coumaroyl-coa
4-Coumaroyl-coenzyme A
CoA 9:5
O
hmdb:HMDB0304822 Coumaroyl-CoA
4-Coumaroyl-coenzyme A
4-Hydroxycinnamoyl-CoA
4-coumaroyl-coa
{[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({hydroxy[(3R)-3-hydroxy-3-({2-[(2-{[3-(4-hydroxyphenyl)prop-2-enoyl]sulfanyl}ethyl)carbamoyl]ethyl}carbamoyl)-2,2-dimethylpropoxy]phosphoryl}oxy)phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid
chebi:11979
chebi:1813
chebi:20349 		secondary/obsolete/fantasy identifier