BIAdb Cis-N-methyl-alpha-berbine 1786

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BIAdb Cis-N-methyl-alpha-berbine 1786
Systematic (IUPAC) name
(7S,13aS)-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium
Identifiers
CAS number	?
ATC code	?
PubChem	11953853
Chemical data
Formula	C18H20N+
Mol. mass	250.3581
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

[edit] Description

[edit] Source

N/A

[edit] Function

Unknown

[edit] General Properties

*Molecular Weight

250.3581

*Exact Mass

250.159575

*Molecular Formula

C₁₈H₂₀N+

*IUPAC NAME

(7S,13aS)-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium

*Canonical Smiles

C[N+]12CCC3=CC=CC=C3C1CC4=CC=CC=C4C2

*Isomeric Smiles

C[N@@+]12CCC3=CC=CC=C3[C@@H]1CC4=CC=CC=C4C2

*XLogP

3.4

*Hydrogen bond donor

0

*Hydrogen bond acceptor

0

*Rotational Bond Count

0

*Topological Polar Surface Area

0

[edit] External Links

• Pubchem

• KEGG

Link to BIAdb Database