6-[(2Z)-3,7-Dimethyl-5-oxoocta-2,6-dien-1-yl]-7-hydroxy-5-methoxy-2-(2-phenylethyl)-2,3-dihydro-1H-isoindol-1-one

Properties Image MNX_ID MNXM126423 reference chebi:184928 formula C27H31NO4 global charge 0 mol weight 433.548 InChIKey ZJTHOPGQZOXEJX-GRSHGNNSSA-N InChI InChI=1S/C27H31NO4/c1-18(2)14-22(29)15-19(3)10-11-23-24(32-4)16-21-17-28(27(31)25(21)26(23)30)13-12-20-8-6-5-7-9-20/h5-10,14,16,30H,11-13,15,17H2,1-4H3/b19-10- SMILES COC1=CC2=C(C(=O)N(CCC3=CC=CC=C3)C2)C(O)=C1C/C=C(/C)CC(=O)C=C(C)C MNX internals InChI (mnx) InChI=1/C27H31NO4/c1-18(2)14-22(29)15-19(3)10-11-23-24(32-4)16-21-17-28(27(31)25(21)26(23)30)13-12-20-8-6-5-7-9-20/h5-10,14,16,30H,11-13,15,17H2,1-4H3/b19-10- SMILES (mnx) [CH3:1][C:18]([CH3:2])=[CH:14][C:22]([CH2:15]/[C:19]([CH3:3])=[CH:10]\[CH2:11][C:23]1=[C:24]([O:32][CH3:4])[CH:16]=[C:21]2[CH2:17][N:28]([CH2:13][CH2:12][C:20]3=[CH:8][CH:6]=[CH:5][CH:7]=[CH:9]3)[C:27](=[O:31])[C:25]2=[C:26]1[OH:30])=[O:29]

Parent-child relations graph

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