BIAdb Corydaline 1949

BIAdb Corydaline 1949
Systematic (IUPAC) name
(13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[3,2-a]isoquinoline
Identifiers
CAS number	?
ATC code	?
PubChem	101301
Chemical data
Formula	C₂₂H₂₇NO₄
Mol. mass	369.45408
SMILES	eMolecules & PubChem
Pharmacokinetic data
Bioavailability	?
Metabolism	?
Half life	?
Excretion	?
Therapeutic considerations
Pregnancy cat.	?
Legal status
Routes	?

[edit] Description

Corydalis turtschaninowii

Acetylcholinesterase inhibitor

*Molecular Weight

369.45408

*Exact Mass

369.194008

*Molecular Formula

C₂₂H₂₇NO₄

*IUPAC NAME

(13S,13aR)-2,3,9,10-tetramethoxy-13-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[3,2-a]isoquinoline

*Canonical Smiles

CC1C2C3=CC(=C(C=C3CCN2CC4=C1C=CC(=C4OC)OC)OC)OC

*Isomeric Smiles

C[C@@H]1[C@@H]2C3=CC(=C(C=C3CCN2CC4=C1C=CC(=C4OC)OC)OC)OC

*XLogP

3.6

*Hydrogen bond donor

0

*Hydrogen bond acceptor

5

*Rotational Bond Count

4

*Topological Polar Surface Area

40.2