Molecule ID: 12235230

IUPAC Name: (9S,10S)-9,10-dihydroxyoctadecanoic acid

Description: The molecule is a 9,10-dihydroxyoctadecanoic acid diastereoisomer in which both stereocentres have S configuration. It is a conjugate acid of a (S,S)-9,10-dihydroxyoctadecanoate.

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

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

InChI: InChI=1S/C18H36O4/c1-2-3-4-5-7-10-13-16(19)17(20)14-11-8-6-9-12-15-18(21)22/h16-17,19-20H,2-15H2,1H3,(H,21,22)/t16-,17-/m0/s1

Molecular Properties:
- Polar Surface Area: 77.8 Ų
- LogP: 5.1