phytanic acid

Ligand id: 2813

Name: phytanic acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 14
Topological polar surface area 37.3
Molecular weight 312.3
XLogP 9.6
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
3,7,11,15-Tetramethylhexadecanoic acid
Database Links
CAS Registry No. 14721-66-5 (source: Scifinder)
ChEBI CHEBI:16285
NURSA Ligand 10.1621/3ZSWYQCXB2
PubChem CID 26840
Search Google for chemical match using the InChIKey RLCKHJSFHOZMDR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone RLCKHJSFHOZMDR
Search UniChem for chemical match using the InChIKey RLCKHJSFHOZMDR-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone RLCKHJSFHOZMDR
Wikipedia Phytanic_acid