Molecule ID: 5281727

IUPAC Name: 4-[(E)-2-(3,5-dimethoxyphenyl)ethenyl]phenol

Description: The molecule is a stilbenol that consists of trans-stilbene bearing a hydroxy group at position 4 as well as two methoxy substituents at positions 3' and 5'. It has a role as a metabolite, an antioxidant, an antineoplastic agent and a neurotransmitter. It derives from a hydride of a trans-stilbene.

SMILES: COc1cc(/C=C/c2ccc(O)cc2)cc(OC)c1

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

InChI: InChI=1S/C16H16O3/c1-18-15-9-13(10-16(11-15)19-2)4-3-12-5-7-14(17)8-6-12/h3-11,17H,1-2H3/b4-3+

Molecular Properties:
- Polar Surface Area: 38.7 Ų
- LogP: 3.8