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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL267476
CHEMBL267476
Compound Name LINOLEIC ACID
ChEMBL Synonyms Sodium Linolate | Octadeca-9,12-Dienoic Acid
Max Phase 0
Trade Names
Molecular Formula C18H32O2

Additional synonyms for CHEMBL267476 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCCCC\C=C/C\C=C/CCCCCCCC(=O)O
Standard InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17 ...
Download InChI
Standard InChI Key OYHQOLUKZRVURQ-HZJYTTRNSA-N

Structural Alerts

There are 7 structural alerts for CHEMBL267476. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL267476

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
280.5 280.2402 6.42 14 37.29 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 1 1 2 1 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
13.32 8.92 4.01 1.54 0 20 0.29

Compound Cross References

ChemSpider ChemSpider:OYHQOLUKZRVURQ-HZJYTTRNSA-N
PubChem SID: 144204618 SID: 144209369 SID: 144213397 SID: 17388946 SID: 26752888
Wikipedia Linoleic_acid

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL267476



ACToR 506-21-8 2197-37-7 80969-37-5
BindingDB 22231
ChEBI 17351
eMolecules 26755855 524840
EPA CompTox Dashboard DTXSID2025505
FDA SRS 9KJL21T0QJ
Guide to Pharmacology 1052
Human Metabolome Database HMDB00673
KEGG Ligand C01595
LINCS LSM-42867
MolPort MolPort-001-788-459
Nikkaji J4.801A
PDBe EIC
PubChem 5280450
PubChem: Thomson Pharma 14897568
SureChEMBL SCHEMBL7067

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/OYHQOLUKZRVURQ-HZJYTTRNSA-N spacer
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