Molecule ID: 57468560

IUPAC Name: 3,18-dihydroxyoctadecanoic acid

Description: The molecule is a dihydroxy monocarboxylic acid that consists of octadecanoic (stearic) acid bearing two hydroxy substituents at positions 3 and 18. It is an omega-hydroxy fatty acid, a 3-hydroxy fatty acid, a dihydroxy monocarboxylic acid and a hydroxyoctadecanoic acid. It is a conjugate acid of a 3,18-dihydroxyoctadecanoate.

SMILES: O=C(O)CC(O)CCCCCCCCCCCCCCCO

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

InChI: InChI=1S/C18H36O4/c19-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-17(20)16-18(21)22/h17,19-20H,1-16H2,(H,21,22)

Molecular Properties:
- Polar Surface Area: 77.8 Ų
- LogP: 5.3