4-coumaroyl-diketide

Properties Image MNX_ID MNXM12561 reference metacycM:CPD-12208 formula C11H9O4 global charge -1 mol weight 205.189 InChIKey VKCHGHDJFMXENE-ZZXKWVIFSA-M InChI InChI=1S/C11H10O4/c12-9-4-1-8(2-5-9)3-6-10(13)7-11(14)15/h1-6,12H,7H2,(H,14,15)/p-1/b6-3+ SMILES O=C([O-])CC(=O)/C=C/C1=CC=C(O)C=C1 MNX internals InChI (mnx) InChI=1/C11H10O4/c12-9-4-1-8(2-5-9)3-6-10(13)7-11(14)15/h1-6,12H,7H2,(H,14,15)/b6-3+ SMILES (mnx) [CH:1]1=[CH:4][C:9]([OH:12])=[CH:5][CH:2]=[C:8]1/[CH:3]=[CH:6]/[C:10]([CH2:7][C:11](=[O:14])[OH:15])=[O:13]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 5 in models (compartimentalized) 0