Molecule ID: 122391308

IUPAC Name: (8Z,11Z,14Z)-10-hydroperoxyicosa-8,11,14-trienoic acid

Description: The molecule is a hydroperoxyicosatrienoic acid that is (8Z,11Z,14Z)-icosatrienoic acid in which the hydroperoxy substituent is located at position 10. It derives from an all-cis-icosa-8,11,14-trienoic acid. It is a conjugate acid of an (8Z,11Z,14Z)-10-hydroperoxyicosatrienoate.

SMILES: CCCCC/C=C\C/C=C\C(/C=C\CCCCCCC(=O)O)OO

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

InChI: InChI=1S/C20H34O4/c1-2-3-4-5-6-7-10-13-16-19(24-23)17-14-11-8-9-12-15-18-20(21)22/h6-7,13-14,16-17,19,23H,2-5,8-12,15,18H2,1H3,(H,21,22)/b7-6-,16-13-,17-14-

Molecular Properties:
- Polar Surface Area: 66.8 Ų
- LogP: 5.9