Molecule ID: 86289833

IUPAC Name: (3R,12R)-3,12-dihydroxytridecanoic acid

Description: The molecule is an (omega-1)-hydroxy fatty acid that is (12R)-12-hydroxytridecanoic acid in which the 3-pro-R hydrogen is replaced by a hydroxy group. It is an (omega-1)-hydroxy fatty acid, a 3-hydroxy carboxylic acid, a dihydroxy monocarboxylic acid and a long-chain fatty acid. It derives from a (12R)-12-hydroxytridecanoic acid.

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

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

InChI: InChI=1S/C13H26O4/c1-11(14)8-6-4-2-3-5-7-9-12(15)10-13(16)17/h11-12,14-15H,2-10H2,1H3,(H,16,17)/t11-,12-/m1/s1

Molecular Properties:
- Polar Surface Area: 77.8 Ų
- LogP: 2.4