5-oxo-ODE

Ligand id: 6164

Name: 5-oxo-ODE

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 14
Topological polar surface area 54.37
Molecular weight 294.22
XLogP 5.87
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
(6E,8Z)-5-oxooctadeca-6,8-dienoic acid
Synonyms
5-oxo-(6E,8Z)-octadecadienoic acid
Database Links
CAS Registry No. 1021188-25-9 (source: Scifinder)
PubChem CID 71751402
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