Molecule ID: 14017333

IUPAC Name: 4-[3-(2-hydroxy-4-methoxyphenyl)propyl]-2-methoxyphenol

Description: The molecule is a monomethoxybenzene that is 2-methoxyphenol substituted by a 3-(2-hydroxy-4-methoxyphenyl)propyl group at position 4. Isolated from the stems of Combretum griffithii, it exhibits anticancer activity. It has a role as a metabolite, an antimycobacterial drug, an antineoplastic agent and a plant metabolite.

SMILES: COc1ccc(CCCc2ccc(O)c(OC)c2)c(O)c1

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

InChI: InChI=1S/C17H20O4/c1-20-14-8-7-13(16(19)11-14)5-3-4-12-6-9-15(18)17(10-12)21-2/h6-11,18-19H,3-5H2,1-2H3

Molecular Properties:
- Polar Surface Area: 58.9 Ų
- LogP: 3.9