Nantenine

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Revision as of 05:48, 23 April 2009

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Nantenine
Systematic (IUPAC) name
N/A
Identifiers
CAS number	?
ATC code	?
PubChem	197001
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	?

Description

from Nandina domestica Thundberg; RN given refers to (S)-isomer; structure given in first source

General Properties

*Molecular Weight

339.38504

*Molecular Formula

C₂₀H₂₁NO₄

*IUPAC NAME

N/A

*Canonical Smiles

CN1CCC2=CC(=C(C3=C2C1CC4=CC5=C(C=C43)OCO5)OC)OC

*Isomeric Smiles

CN1CCC2=CC(=C(C3=C2[C@@H]1CC4=CC5=C(C=C43)OCO5)OC)OC

*XLogP

2.8

*Topological Polar Surface Area

40.2

External Links

• Pubchem

Link to BIAdb Database