Molecule ID: 667639

IUPAC Name: 4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]benzene-1,2-diol

Description: The molecule is a stilbenol that is trans-stilbene in which one of the phenyl groups is substituted by hydroxy groups at positions 3 and 4, while the other phenyl group is substituted by hydroxy groups at positions 3 and 5. It has a role as a protein kinase inhibitor, a tyrosine kinase inhibitor, an antineoplastic agent, a plant metabolite, a hypoglycemic agent and an apoptosis inducer. It is a stilbenol, a member of resorcinols, a member of catechols and a polyphenol. It derives from a hydride of a trans-stilbene.

SMILES: Oc1cc(O)cc(/C=C/c2ccc(O)c(O)c2)c1

SELFIES: [O][C][=C][C][Branch1][C][O][=C][C][Branch1][P][/C][=C][/C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2][=C][Ring1][P]

InChI: InChI=1S/C14H12O4/c15-11-5-10(6-12(16)8-11)2-1-9-3-4-13(17)14(18)7-9/h1-8,15-18H/b2-1+

Molecular Properties:
- Polar Surface Area: 80.9 Ų
- LogP: 2.9