Molecule ID: 363863

IUPAC Name: 5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),14,16-hexaen-16-ol

Description: The molecule is a member of the class of ptercoarpans that is cis-pterocarpan substituted by a hydroxy group at position 3 and a methylenedioxy group across positions 8 and 9. It is a member of pterocarpans and a member of phenols.

SMILES: Oc1ccc2c(c1)OCC1c3cc4c(cc3OC21)OCO4

SELFIES: [O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][C][=C][C][=C][Branch1][O][C][=C][Ring1][=Branch1][O][C][Ring1][=C][Ring1][=Branch2][O][C][O][Ring1][=Branch2]

InChI: InChI=1S/C16H12O5/c17-8-1-2-9-12(3-8)18-6-11-10-4-14-15(20-7-19-14)5-13(10)21-16(9)11/h1-5,11,16-17H,6-7H2

Molecular Properties:
- Polar Surface Area: 57.2 Ų
- LogP: 2.5