3-geranylflaviolin

Properties Image MNX_ID MNXM150892 reference metacycM:CPD-16657 formula C20H22O5 global charge 0 mol weight 342.391 InChIKey FWXGFZYOLNDRLJ-KPKJPENVSA-N InChI InChI=1S/C20H22O5/c1-11(2)5-4-6-12(3)7-8-14-18(23)17-15(20(25)19(14)24)9-13(21)10-16(17)22/h5,7,9-10,21-22,24H,4,6,8H2,1-3H3/b12-7+ SMILES CC(C)=CCC/C(C)=C/CC1=C(O)C(=O)C2=C(C1=O)C(O)=CC(O)=C2 MNX internals InChI (mnx) InChI=1/C20H22O5/c1-11(2)5-4-6-12(3)7-8-14-18(23)17-15(20(25)19(14)24)9-13(21)10-16(17)22/h5,7,9-10,21-22,24H,4,6,8H2,1-3H3/b12-7+ SMILES (mnx) [CH3:1][C:11]([CH3:2])=[CH:5][CH2:4][CH2:6]/[C:12]([CH3:3])=[CH:7]/[CH2:8][C:14]1=[C:19]([OH:24])[C:20](=[O:25])[C:15]2=[C:17]([C:16]([OH:22])=[CH:10][C:13]([OH:21])=[CH:9]2)[C:18]1=[O:23]

Parent-child relations graph

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