Oxyberberine; 8ξ-Alcohol

AlkaPlorer ID: AK309101

Synonym: 7,8-Dihydro-8-hydroxyberberine, Berberinol

IUPAC Name: 16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(21),2,4(8),9,15(20),16,18-heptaen-14-ol

Structure

SMILES: COC1=CC=C2C=C3C4=CC5=C(C=C4CCN3C(O)C2=C1OC)OCO5

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InChI: InChI=1S/C20H19NO5/c1-23-15-4-3-12-7-14-13-9-17-16(25-10-26-17)8-11(13)5-6-21(14)20(22)18(12)19(15)24-2/h3-4,7-9,20,22H,5-6,10H2,1-2H3

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InChIKey: ZRBGFWOXAQPDTH-UHFFFAOYSA-N

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Properties Information

Molecule Weight: 353.37400000000014

TPSA: 60.390000000000015

MolLogP: 2.793200000000001

Number of H-Donors: 1

Number of H-Acceptors: 6

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information