Oxyberberine

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-one

CAS: 549-21-3

Molecular Formula	`C20H17NO5`
Molecular Weight	351.4 g/mol
LogP	2.9
Topological Polar Surface Area	57.2 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	351.1107
Heavy Atoms	26
Complexity	607.0

Chemical Identifiers

CAS Number	549-21-3
SMILES	`COC1=C(C2=C(C=C1)C=C3C4=CC5=C(C=C4CCN3C2=O)OCO5)OC`
InChIKey	`ZHYQCBCBTQWPLC-UHFFFAOYSA-N`

📖 Product Overview

Oxyberberine (CAS: 549-21-3) is a chemical compound with molecular formula C20H17NO5 and molecular weight 351.4 g/mol. Its IUPAC systematic name is 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-one. LogP 2.9 Topological Polar Surface Area 57.2 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 2 Exact Mass 351.1107 Heavy Atoms 26 Complexity 607.0 InChI Key: ZHYQCBCBTQWPLC-UHFFFAOYSA-N. SMILES: COC1=C(C2=C(C=C1)C=C3C4=CC5=C(C=C4CCN3C2=O)OCO5)OC.

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