berberine Report issue

Small molecule Experimental
AACT ChEMBL DrugBank PubChem

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Chemistry

Mol. Mass

336.37

ALogP

3.1

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COc1ccc2cc3[n+](cc2c1OC)CCc1cc2c(cc1-3)OCO2
  • InChIKey: YBHILYKTIRIUTE-UHFFFAOYSA-N
    InChI=1S/C20H18NO4/c1-22-17-4-3-12-7-16-14-9-19-18(24-11-25-19)8-13(14)5-6-21(16)10-15(12)20(17)23-2/h3-4,7-10H,5-6,11H2,1-2H3/q+1
  • Chirality: Achiral Molecule
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL295124   ChEMBL
berberine *

CHEMBL12089   ChEMBL
berberine chloride

Berberine   Wikipedia

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