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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL484853
CHEMBL484853
Compound Name CARNOSIC ACID
ChEMBL Synonyms Carnosic Acid | Carsonic Acid | Carnosolic Acid
Max Phase 0
Trade Names
Molecular Formula C20H28O4

Additional synonyms for CHEMBL484853 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC(C)c1cc2CC[C@H]3C(C)(C)CCC[C@]3(C(=O)O)c2c(O)c1O
Standard InChI InChI=1S/C20H28O4/c1-11(2)13-10-12-6-7-14-19(3,4)8-5-9-20(14 ...
Download InChI
Standard InChI Key QRYRORQUOLYVBU-VBKZILBWSA-N

Structural Alerts

There are 3 structural alerts for CHEMBL484853. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL484853

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
332.4 332.1988 4.91 2 77.76 ACID


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
4 3 0 4 3 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
4.14 - 5.41 2.26 1 24 0.67

Compound Cross References

ChemSpider ChemSpider:QRYRORQUOLYVBU-VBKZILBWSA-N
PubChem SID: 26755271 SID: 524212
Wikipedia Carnosic_acid

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL484853



ACToR 3650-09-7
BindinDB 50371232
ChEBI 65585
eMolecules 1936077
FDA SRS LI791SXT24
IBM Patent System 64C75D841C201047A9B7875E24606EFE
IBM Patents US20100317728 US20100210859 US20100217036
Nikkaji J16.357K
PubChem 65126
PubChem: Drugs of the Future 136349972
PubChem: Thomson Pharma 14753270
SureChEMBL SCHEMBL9923661

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