Molecule ID: 86289871

IUPAC Name: (3R)-3,20-dihydroxyicosanoic acid

Description: The molecule is a dihydroxy monocarboxylic acid that is 20-hydroxyicosanoic acid in which the pro-R hydrogen beta to the carboxy group is replaced by a hydroxy group. It is a 3-hydroxy carboxylic acid, an omega-hydroxy fatty acid, a dihydroxy monocarboxylic acid and a long-chain fatty acid. It derives from a 20-hydroxyicosanoic acid.

SMILES: O=C(O)C[C@H](O)CCCCCCCCCCCCCCCCCO

SELFIES: [O][=C][Branch1][C][O][C][C@H1][Branch1][C][O][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][C][O]

InChI: InChI=1S/C20H40O4/c21-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-19(22)18-20(23)24/h19,21-22H,1-18H2,(H,23,24)/t19-/m1/s1

Molecular Properties:
- Polar Surface Area: 77.8 Ų
- LogP: 6.3