Molecule ID: 57465470

IUPAC Name: (Z)-14-hydroxy-10,13-dioxoheptadec-7-enoic acid

Description: The molecule is a monounsaturated fatty acid that is (7Z)-heptadec-7-enoic acid which is substituted by a hydroxy group at position 14 and by oxo groups at positions 10 and 13. It is a hydroxy fatty acid, an oxo fatty acid, a diketone, a hydroxy monounsaturated fatty acid and a secondary alpha-hydroxy ketone.

SMILES: CCCC(O)C(=O)CCC(=O)C/C=C\CCCCCC(=O)O

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

InChI: InChI=1S/C17H28O5/c1-2-9-15(19)16(20)13-12-14(18)10-7-5-3-4-6-8-11-17(21)22/h5,7,15,19H,2-4,6,8-13H2,1H3,(H,21,22)/b7-5-

Molecular Properties:
- Polar Surface Area: 91.7 Ų
- LogP: 2.0