Molecule ID: 157288

IUPAC Name: 4-[3-(4-hydroxyphenyl)penta-1,4-dienyl]phenol

Description: The molecule is a norlignan that is pentane-1,4-diene in which a hydrogen at position 1 and a hydrogen at position 3 are replaced by p-hydroxyphenyl groups. The isomer in which the 1,2-disubstituted double bond has Z configuration is known as nyasol; the corresponding E isomer is hinokiresinol. It has a role as a plant metabolite. It is a norlignan, a polyphenol and an olefinic compound.

SMILES: C=CC(C=Cc1ccc(O)cc1)c1ccc(O)cc1

SELFIES: [C][=C][C][Branch1][=C][C][=C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]

InChI: InChI=1S/C17H16O2/c1-2-14(15-7-11-17(19)12-8-15)6-3-13-4-9-16(18)10-5-13/h2-12,14,18-19H,1H2

Molecular Properties:
- Polar Surface Area: 40.5 Ų
- LogP: 4.4