Molecule ID: 6426042

IUPAC Name: 1,2-bis(4-hydroxy-3-methoxyphenyl)propane-1,3-diol

Description: The molecule is a member of the class of propane-1,3-diols that is propane-1,3-diol substituted by 4-hydroxy-3-methoxyphenyl groups at positions 1 and 2 respectively. It has a role as a plant metabolite. It is a member of propane-1,3-diols and a member of guaiacols.

SMILES: COc1cc(C(O)C(CO)c2ccc(O)c(OC)c2)ccc1O

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

InChI: InChI=1S/C17H20O6/c1-22-15-7-10(3-5-13(15)19)12(9-18)17(21)11-4-6-14(20)16(8-11)23-2/h3-8,12,17-21H,9H2,1-2H3

Molecular Properties:
- Polar Surface Area: 99.4 Ų
- LogP: 1.4