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(E)-2,4-dihydroxycinnamoyl-CoA

PropertiesImageOccurences in reactions
MNX_IDMNXM9765Image of MNXM9765
#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
formulaC30H38N7O19P3S
charge-4
mass925.1178
referencechebi:142398
InChIKeyPGFXNMKOJHFQIE-ZSELIEHESA-J
InChIInChI=1S/C30H42N7O19P3S/c1-30(2,25(43)28(44)33-8-7-20(40)32-9-10-60-21(41)6-4-16-3-5-17(38)11-18(16)39)13-53-59(50,51)56-58(48,49)52-12-19-24(55-57(45,46)47)23(42)29(54-19)37-15-36-22-26(31)34-14-35-27(22)37/h3-6,11,14-15,19,23-25,29,38-39,42-43H,7-10,12-13H2,1-2H3,(H,32,40)(H,33,44)(H,48,49)(H,50,51)(H2,31,34,35)(H2,45,46,47)/p-4/b6-4+/t19-,23-,24-,25+,29-/m1/s1
SMILESCC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)/C=C/c1ccc(O)cc1O
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:142398
chebi:142398 		(E)-2,4-dihydroxycinnamoyl-CoA
trans-2,4-dihydroxy-cinnamoyl-CoA(4-)
kegg.compound:C22070
keggC:C22070 		2,4-Dihydroxycinnamoyl-CoA
(2E)-3-(2,4-Dihydroxyphenyl)prop-2-enoyl-CoA
seed.compound:cpd24121
seedM:cpd24121 		2,4-dihydroxycinnamoyl-CoA
metacyc.compound:CPD-14010
metacycM:CPD-14010 		2,4-dihydroxycinnamoyl-CoA
(E)-3-(2,4-dihydroxyphenyl)-prop-2-enoyl-CoA
keggC:M_C22070
seedM:M_cpd24121 		secondary/obsolete/fantasy identifier