Molecule ID: 5282943

IUPAC Name: (E)-12-hydroxyoctadec-9-enoic acid

Description: The molecule is a hydroxy fatty acid that is (9E)-octadec-9-enoic (elaidic) acid carrying a hydroxy substituent at position 12. It is a hydroxy fatty acid, a long-chain fatty acid and a hydroxy monounsaturated fatty acid. It derives from an elaidic acid. It is a conjugate acid of a (9E)-12-hydroxyoctadec-9-enoate.

SMILES: CCCCCCC(O)C/C=C/CCCCCCCC(=O)O

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

InChI: InChI=1S/C18H34O3/c1-2-3-4-11-14-17(19)15-12-9-7-5-6-8-10-13-16-18(20)21/h9,12,17,19H,2-8,10-11,13-16H2,1H3,(H,20,21)/b12-9+

Molecular Properties:
- Polar Surface Area: 57.5 Ų
- LogP: 5.7