Molecule ID: 86289657

IUPAC Name: (E,6R)-6-hydroxyhept-2-enoic acid

Description: The molecule is a hydroxy fatty acid that is trans-2-heptenoic acid in which the 6-pro-R hydrogen is replaced by a hydroxy group. It is a medium-chain fatty acid, an (omega-1)-hydroxy fatty acid, an alpha,beta-unsaturated monocarboxylic acid and a hydroxy monounsaturated fatty acid. It derives from an (E)-hept-2-enoic acid.

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

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

InChI: InChI=1S/C7H12O3/c1-6(8)4-2-3-5-7(9)10/h3,5-6,8H,2,4H2,1H3,(H,9,10)/b5-3+/t6-/m1/s1

Molecular Properties:
- Polar Surface Area: 57.5 Ų
- LogP: 0.6