oleic acid

Ligand id: 1054

Name: oleic acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 15
Topological polar surface area 37.3
Molecular weight 282.26
XLogP 8.19
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
(Z)-Octadec-9-enoic acid
Synonyms
C18:1 | oleate
Database Links
BindingDB Ligand 50150484
CAS Registry No. 112-80-1 (source: ChEBI)
ChEBI CHEBI:16196
ChEMBL Ligand CHEMBL8659
NURSA Ligand 10.1621/6AB7EWJ53L
PubChem CID 445639
RCSB PDB Ligand OLA
Search Google for chemical match using the InChIKey ZQPPMHVWECSIRJ-KTKRTIGZSA-N
Search Google for chemicals with the same backbone ZQPPMHVWECSIRJ
Search UniChem for chemical match using the InChIKey ZQPPMHVWECSIRJ-KTKRTIGZSA-N
Search UniChem for chemicals with the same backbone ZQPPMHVWECSIRJ
Wikipedia Oleic_acid