BIAdb Columbamine chloride 1930

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Revision as of 11:11, 20 November 2009

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BIAdb Columbamine chloride 1930
Systematic (IUPAC) name
3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-olchloride
Identifiers
CAS number	?
ATC code	?
PubChem	15840198
Chemical data
Formula	C20H20ClNO4
Mol. mass	373.8301
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

Contents 1 Description 2 Source 3 Function 4 General Properties 5 External Links

Description

Source

N/A

Function

Unknown

General Properties

*Molecular Weight

373.8301

*Exact Mass

373.108086

*Molecular Formula

C₂₀H₂₀ClNO₄

*IUPAC NAME

3,9,10-trimethoxy-5,6-dihydroisoquinolino[2,1-b]isoquinolin-7-ium-2-olchloride

*Canonical Smiles

COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC(=C(C=C4CC3)OC)O)OC.[Cl-]

*Isomeric Smiles

N/A

*XLogP

N/A

*Hydrogen bond donor

1

*Hydrogen bond acceptor

5

*Rotational Bond Count

3

*Topological Polar Surface Area

51.8

External Links

• Pubchem

Link to BIAdb Database