General
Preferred name
OLEIC ACID
Synonyms
trans-Oleic Acid ()
ELAIDIC ACID ()
9(E)-Octadecenoic acid ()
Octadec-9-Enoic Acid Anion ()
Elaidic Acid-d17 ()
P&D ID
PD006866
CAS
112-79-8
2027-47-6
26764-26-1
112-80-1
Tags
natural product
drug
available
Drug Status
investigational
approved
vet_approved
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
8
DrugBank
DrugBank Approved Drugs
EU-OPENSCREEN Bioactive Compound Library
MedChem Express Bioactive Compound Library
ReFrame library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
38
Properties
(calculated by RDKit )
Molecular Weight
282.26
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
15
Ring Count
0
Aromatic Ring Count
0
cLogP
6.11
TPSA
37.3
Fraction CSP3
0.83
Chiral centers
0.0
Largest ring
0.0
QED
0.29
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolism
Metabolic Enzyme/Protease
Target
Human Endogenous Metabolite
Apoptosis related,ROS
MOA
Endogenous Metabolite
Source data
