Molecule ID: 129320481

IUPAC Name: (3R,4R)-3-(2,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-4,7-diol

Description: The molecule is a member of the class of hydroxyisoflavans that is isoflavan-4-ol which is substituted at positions 7, 2' and 4' by hydroxy groups (the 3R,4R stereoisomer). It is a member of hydroxyisoflavans and a member of resorcinols.

SMILES: Oc1ccc([C@@H]2COc3cc(O)ccc3[C@@H]2O)c(O)c1

SELFIES: [O][C][=C][C][=C][Branch2][Ring1][Ring1][C@@H1][C][O][C][=C][C][Branch1][C][O][=C][C][=C][Ring1][#Branch1][C@@H1][Ring1][O][O][C][Branch1][C][O][=C][Ring2][Ring1][Ring1]

InChI: InChI=1S/C15H14O5/c16-8-1-3-10(13(18)5-8)12-7-20-14-6-9(17)2-4-11(14)15(12)19/h1-6,12,15-19H,7H2/t12-,15-/m0/s1

Molecular Properties:
- Polar Surface Area: 90.2 Ų
- LogP: 1.5