**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

p-Coumaroyl-diketide-CoA

Properties Image Occurences in reactions MNX_ID MNXM1377452 #reac in my sandbox 0 in MNXref (generic) 5 in models (compartimentalized) 0 formula C32H44N7O19P3S charge 0 mass 955.713 reference keggC:C17740 InChIKey FZWJGTSJBJBNKS-VVHSVQLPSA-N InChI InChI=1S/C32H44N7O19P3S/c1-32(2,27(45)30(46)35-10-9-22(42)34-11-12-62-23(43)13-20(41)8-5-18-3-6-19(40)7-4-18)15-55-61(52,53)58-60(50,51)54-14-21-26(57-59(47,48)49)25(44)31(56-21)39-17-38-24-28(33)36-16-37-29(24)39/h3-8,16-17,21,25-27,31,40,44-45H,9-15H2,1-2H3,(H,34,42)(H,35,46)(H,50,51)(H,52,53)(H2,33,36,37)(H2,47,48,49)/b8-5+/t21-,25-,26-,27+,31-/m1/s1 SMILES [CH3:1][C:32]([CH3:2])([CH2:15][O:55][P:61]([OH:52])(=[O:53])[O:58][P:60]([OH:50])(=[O:51])[O:54][CH2:14][C@@H:21]1[C@@H:26]([O:57][P:59]([OH:47])([OH:48])=[O:49])[C@@H:25]([OH:44])[C@H:31]([n:39]2[cH:17][n:38][c:24]3[c:28]([NH2:33])[n:36][cH:16][n:37][c:29]32)[O:56]1)[C@H:27]([C:30](=[N:35][CH2:10][CH2:9][C:22](=[N:34][CH2:11][CH2:12][S:62][C:23]([CH2:13][C:20](/[CH:8]=[CH:5]/[c:18]1[cH:3][cH:6][c:19]([OH:40])[cH:7][cH:4]1)=[O:41])=[O:43])[OH:42])[OH:46])[OH:45]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources

Identifier	Description
kegg.compound:C17740 keggC:C17740	p-Coumaroyl-diketide-CoA (4-Coumaroyl)acetyl-CoA
metacyc.compound:CPD-12184 metacycM:CPD-12184	4-coumaroylacetyl-CoA 4-coumaroyl-diketide-CoA 4-coumaroyl-diketide-coenzyme A p-coumaroyl-diketide-CoA p-coumaroyl-diketide-coenzyme A
seed.compound:cpd17837 seedM:cpd17837	p-Coumaroyl-diketide-CoA (4-Coumaroyl)acetyl-CoA 4-coumaroyl-diketide-CoA 4-coumaroyl-diketide-coenzyme A 4-coumaroylacetyl-CoA p-coumaroyl-diketide-CoA p-coumaroyl-diketide-coenzyme A p-coumaroyldiketide-CoA p-coumaroyldiketide-coenzyme A
keggC:M_C17740 seedM:M_cpd17837	secondary/obsolete/fantasy identifier