1-phenyl-7-(3,4-dihydroxyphenyl)-hepta-1,3-dien-5-one

Properties Image MNX_ID MNXM7998 reference metacycM:CPD-12202 formula C19H18O3 global charge 0 mol weight 294.35 InChIKey NDNXUPPJUCZTKB-KBXRYBNXSA-N InChI InChI=1S/C19H18O3/c20-17(9-5-4-8-15-6-2-1-3-7-15)12-10-16-11-13-18(21)19(22)14-16/h1-9,11,13-14,21-22H,10,12H2/b8-4+,9-5+ SMILES O=C(/C=C/C=C/C1=CC=CC=C1)CCC1=CC=C(O)C(O)=C1 MNX internals InChI (mnx) InChI=1/C19H18O3/c20-17(9-5-4-8-15-6-2-1-3-7-15)12-10-16-11-13-18(21)19(22)14-16/h1-9,11,13-14,21-22H,10,12H2/b8-4+,9-5+ SMILES (mnx) [CH:1]1=[CH:2][CH:6]=[C:15](/[CH:8]=[CH:4]/[CH:5]=[CH:9]/[C:17]([CH2:12][CH2:10][C:16]2=[CH:14][C:19]([OH:22])=[C:18]([OH:21])[CH:13]=[CH:11]2)=[O:20])[CH:7]=[CH:3]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0