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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL465183
CHEMBL465183
Compound Name DIHOMO-GAMMA-LINOLENIC ACID
ChEMBL Synonyms Cis-8,11,14-Eicosatrienoicacid
Max Phase 0
Trade Names
Molecular Formula C20H34O2

Additional synonyms for CHEMBL465183 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(=O)O
Standard InChI InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17 ...
Download InChI
Standard InChI Key HOBAELRKJCKHQD-QNEBEIHSSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL465183

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
306.5 306.2559 6.44 15 37.3 ACID


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
4.77 - 7.54 4.95 0 22 0.28

Structural Alerts

There are 7 structural alerts for CHEMBL465183. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:HOBAELRKJCKHQD-QNEBEIHSSA-N
PubChem SID: 26754937 SID: 26754938

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL465183



ACToR 1783-84-2
BindingDB 50269534
Brenda 29652 207722 9996 49928 123483 148685 93314 150163 4495 136272
ChEBI 53486
DrugBank DB00154
eMolecules 509170
FDA SRS FC398RK06S
Guide to Pharmacology 9775
Human Metabolome Database HMDB0002925
KEGG Ligand C03242
LINCS LSM-42904
LipidMaps LMFA01030158
Metabolights MTBLC53486
MolPort MolPort-003-933-184
Nikkaji J110.768B
PDBe LAX
PharmGKB PA164743249
PubChem 5280581
PubChem: Thomson Pharma 14849827
SureChEMBL SCHEMBL842729
ZINC ZINC000004521470

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