5-oxo-12-HETE

Ligand id: 6171

Name: 5-oxo-12-HETE

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 14
Topological polar surface area 74.6
Molecular weight 334.21
XLogP 4.23
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
(6E,8Z,10E,12S,14Z)-12-hydroxy-5-oxoicosa-6,8,10,14-tetraenoic acid
Synonyms
5-oxo-12S-hydroxy-6E,8Z,10E,14Z-eicosatetraenoic acid
Database Links
ChEMBL Ligand CHEMBL3115778
PubChem CID 10568747
Search Google for chemical match using the InChIKey MLZJFLKEKVDNAZ-XPKTZJOPSA-N
Search Google for chemicals with the same backbone MLZJFLKEKVDNAZ
Search UniChem for chemical match using the InChIKey MLZJFLKEKVDNAZ-XPKTZJOPSA-N
Search UniChem for chemicals with the same backbone MLZJFLKEKVDNAZ