Molecule ID: 129320371

IUPAC Name: (2E,5S,6E,8E,10E)-5-hydroxydodeca-2,6,8,10-tetraenal

Description: The molecule is a polyunsaturated fatty aldehyde that is (2E,6E,8E,10E)-dodeca-2,6,8,10-tetraenal in which the pro-S hydrogen at position 5 has been replaced by a hydroxy group. It is a secondary allylic alcohol, an alpha,beta-unsaturated aldehyde, a polyunsaturated fatty aldehyde, a hydroxy fatty aldehyde and a medium-chain fatty aldehyde.

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

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

InChI: InChI=1S/C12H16O2/c1-2-3-4-5-6-9-12(14)10-7-8-11-13/h2-9,11-12,14H,10H2,1H3/b3-2+,5-4+,8-7+,9-6+/t12-/m1/s1

Molecular Properties:
- Polar Surface Area: 37.3 Ų
- LogP: 2.0