MetaADEDB 2.0 @ LMMD
dauricine
(AQASRZOCERRGBL-ROJLCIKYSA-N)
Structure
SMILES
COc1cc2c(cc1OC)CCN([C@@H]2Cc1ccc(cc1)Oc1cc(ccc1O)C[C@H]1N(C)CCc2c1cc(OC)c(c2)OC)C
Molecular Formula:
C38H44N2O6
Molecular Weight:
624.766
Log P:
6.6381
Hydrogen Bond Acceptor:
8
Hydrogen Bond Donor:
1
TPSA:
72.86
CAS Number(s):
524-17-4
Synonym(s)
1.
dauricine
2.
4-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl)-2-(4-((1,2,3,4-tetrahydro-6,7-dimethoxy-2-methyl-1-isoquinolinyl)methyl)phenoxy)phenol
3.
dauricine monohydrochloride
External Link(s)
MeSHC035934
PubChem Compound73400
BindingDB50370415
ChEBI4331
CHEMBLCHEMBL442717
KEGGcpd:C09419
ZINC4098077
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Chemical and Drug Induced Liver Injury19358519CTD
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