MetaADEDB 2.0 @ LMMD
methyllycaconitine
(XLTANAWLDBYGFU-VTLKBQQISA-N)
Structure
SMILES
CCN1C[C@@]2(CC[C@@H]([C@]34[C@H]1[C@](O)([C@H]([C@H]23)OC)[C@@]1([C@@H]2[C@H]4C[C@@H]([C@@H]2OC)[C@H](C1)OC)O)OC)COC(=O)c1ccccc1N1C(=O)C[C@@H](C1=O)C
Molecular Formula:
C37H50N2O10
Molecular Weight:
682.800
Log P:
2.0380
Hydrogen Bond Acceptor:
12
Hydrogen Bond Donor:
2
TPSA:
144.3
CAS Number(s):
21019-30-7
Synonym(s)
1.
methyllycaconitine
2.
methyllycaconitine hydrochloride
3.
methyllycaconitine hydroiodide
External Link(s)
MeSHC054634
PubChem Compound5288811
IUPHAR/BPS Guide to PHARMACOLOGY3980
4005
Therapeutic Target DatabaseD06CDQ
D09VJI
ZINC24707797
Adverse Drug Event(s)
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