Molecule ID: 15391342

IUPAC Name: (3R)-3-(5-methoxy-2,2-dimethylchromen-6-yl)-3,4-dihydro-2H-chromen-7-ol

Description: The molecule is a methoxyisoflavan that is the 2'-O-methyl derivative of (-)-phaseollinisoflavan. It has a role as a plant metabolite. It is a member of hydroxyisoflavans and a methoxyisoflavan. It derives from a (-)-phaseollinisoflavan.

SMILES: COc1c([C@@H]2COc3cc(O)ccc3C2)ccc2c1C=CC(C)(C)O2

SELFIES: [C][O][C][=C][Branch2][Ring1][C][C@@H1][C][O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][C][Ring1][O][C][=C][C][=C][Ring1][P][C][=C][C][Branch1][C][C][Branch1][C][C][O][Ring1][Branch2]

InChI: InChI=1S/C21H22O4/c1-21(2)9-8-17-18(25-21)7-6-16(20(17)23-3)14-10-13-4-5-15(22)11-19(13)24-12-14/h4-9,11,14,22H,10,12H2,1-3H3/t14-/m0/s1

Molecular Properties:
- Polar Surface Area: 47.9 Ų
- LogP: 4.2