Canadine

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Canadine
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	21171
Chemical data
Formula	C₂₀H₂₁NO₄
Mol. mass	339.38504
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

RN given refers to cpd without isomeric designation; structure, Berberis diisoquinoline alkaloid

*Molecular Weight

339.38504

*Molecular Formula

C₂₀H₂₁NO₄

*IUPAC NAME

N/A

*Canonical Smiles

COC1=C(C2=C(CC3C4=CC5=C(C=C4CCN3C2)OCO5)C=C1)OC

*Isomeric Smiles

COC1=C(C2=C(C[C@H]3C4=CC5=C(C=C4CCN3C2)OCO5)C=C1)OC

*XLogP

2.6

*Topological Polar Surface Area

40.2