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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL122972
CHEMBL122972
Compound Name 2-ARACHIDONOYLGLYCEROL
ChEMBL Synonyms 2-Arachidonoyl-Glycerol | 2-Oarachidonoyl Glycerol | 2-Arachidonoylglycerol | 2-Arachidonoyl Glycerol
Max Phase 0
Trade Names
Molecular Formula C23H38O4

Additional synonyms for CHEMBL122972 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)OC(CO)CO
Standard InChI InChI=1S/C23H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17 ...
Download InChI
Standard InChI Key RCRCTBLIHCHWDZ-DOFZRALJSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL122972

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
378.6 378.277 5.61 18 66.76 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
4 2 1 4 2 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
13.54 - 6.36 6.36 0 27 0.19

Structural Alerts

There are 5 structural alerts for CHEMBL122972. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:RCRCTBLIHCHWDZ-DOFZRALJSA-N
PubChem SID: 26755009
Wikipedia 2-Arachidonoylglycerol

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL122972



ACToR 53847-30-6
BindingDB 26144
Brenda 148207 136579 128096 5094 39513
ChEBI 52392
eMolecules 534733
FDA SRS 8D239QDW64
Guide to Pharmacology 729
Human Metabolome Database HMDB0004666
KEGG Ligand C13856
LINCS LSM-44128
LipidMaps LMGL01010023
Metabolights MTBLC52392
MolPort MolPort-003-940-335
Nikkaji J671.147B
PubChem 5282280
PubChem: Drugs of the Future 26683780
PubChem: Thomson Pharma 14902345
Recon C13856
SureChEMBL SCHEMBL136277
ZINC ZINC000004654969

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