4',7-dimethoxy-2,2,4-trimethyl-Delta(3)-isoflavan

Properties Image MNX_ID MNXM39131 reference chebi:79580 formula C20H22O3 global charge 0 mol weight 310.393 InChIKey PNVONQDZKVXBHJ-UHFFFAOYSA-N InChI InChI=1S/C20H22O3/c1-13-17-11-10-16(22-5)12-18(17)23-20(2,3)19(13)14-6-8-15(21-4)9-7-14/h6-12H,1-5H3 SMILES COC1=CC=C(C2=C(C)C3=C(C=C(OC)C=C3)OC2(C)C)C=C1 MNX internals InChI (mnx) InChI=1/C20H22O3/c1-13-17-11-10-16(22-5)12-18(17)23-20(2,3)19(13)14-6-8-15(21-4)9-7-14/h6-12H,1-5H3 SMILES (mnx) [CH3:1][C:13]1=[C:19]([C:14]2=[CH:7][CH:9]=[C:15]([O:21][CH3:4])[CH:8]=[CH:6]2)[C:20]([CH3:2])([CH3:3])[O:23][C:18]2=[C:17]1[CH:11]=[CH:10][C:16]([O:22][CH3:5])=[CH:12]2

Parent-child relations graph

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