MetaADEDB 2.0 @ LMMD
canadine
(VZTUIEROBZXUFA-UHFFFAOYSA-N)
Structure
SMILES
COc1c(OC)ccc2c1CN1CCc3c(C1C2)cc1c(c3)OCO1
Molecular Formula:
C20H21NO4
Molecular Weight:
339.385
Log P:
3.0259
Hydrogen Bond Acceptor:
5
Hydrogen Bond Donor:
0
TPSA:
40.16
CAS Number(s):
522-97-4; 29074-38-2
Synonym(s)
1.
canadine
2.
canadine hydrochloride
3.
canadine, (+-)-isomer
4.
canadine, (R)-isomer
5.
canadine, (S)-isomer
6.
tetrahydroberberine
External Link(s)
MeSHC004645
PubChem Compound34458
BindingDB50203122
ChEBI22998
CHEMBLCHEMBL275097
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Chemical and Drug Induced Liver Injury28257954CTD
2Edema28257954CTD
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