Molecule ID: 11507326

IUPAC Name: 3-[(E)-2-(3-hydroxy-5-methoxyphenyl)ethenyl]-2-methoxyphenol

Description: The molecule is a stilbenoid that is trans-stilbene substituted by hydroxy groups at positions 3 and 3' and methoxy groups at positions 2' and 5. Isolated from Pholidota yunnanensis, it exhibits inhibitory activity on nitric oxide production. It has a role as a metabolite and an EC 1.14.13.39 (nitric oxide synthase) inhibitor. It is a stilbenoid, a member of methoxybenzenes and a polyphenol.

SMILES: COc1cc(O)cc(/C=C/c2cccc(O)c2OC)c1

SELFIES: [C][O][C][=C][C][Branch1][C][O][=C][C][Branch1][S][/C][=C][/C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][O][C][=C][Ring2][Ring1][C]

InChI: InChI=1S/C16H16O4/c1-19-14-9-11(8-13(17)10-14)6-7-12-4-3-5-15(18)16(12)20-2/h3-10,17-18H,1-2H3/b7-6+

Molecular Properties:
- Polar Surface Area: 58.9 Ų
- LogP: 3.4