BIAdb Tetrahydropalmatine 3308

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BIAdb Tetrahydropalmatine 3308
Systematic (IUPAC) name
2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium chloride
Identifiers
CAS number	?
ATC code	?
PubChem	17265
Chemical data
Formula	C₂₁H₂₆ClNO₄
Mol. mass	391.88844
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

N/A

Unknown

*Molecular Weight

391.88844

*Exact Mass

391.155036

*Molecular Formula

C₂₁H₂₆ClNO₄

*IUPAC NAME

2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium chloride

*Canonical Smiles

COC1=C(C2=C(CC3C4=CC(=C(C=C4CC[NH+]3C2)OC)OC)C=C1)OC.[Cl-]

*Isomeric Smiles

N/A

*XLogP

N/A

*Hydrogen bond donor

1

*Hydrogen bond acceptor

5

*Rotational Bond Count

4

*Topological Polar Surface Area

41.4