MetaADEDB 2.0 @ LMMD
cannogenin thevetoside
(PMTSPAGBAFCORP-HBUONDEYSA-N)
Structure
SMILES
CO[C@H]1[C@H](O)[C@H](O[C@H]2CC[C@]3([C@@H](C2)CC[C@@H]2[C@@H]3CC[C@]3([C@]2(O)CC[C@@H]3C2=CC(=O)OC2)C)C=O)O[C@H]([C@@H]1O)C
Type(s)
Experimental
ATC code(s)
C01AX02
Molecular Formula:
C30H44O9
Molecular Weight:
548.665
Log P:
2.2892
Hydrogen Bond Acceptor:
9
Hydrogen Bond Donor:
3
TPSA:
131.75
CAS Number(s):
1182-87-2
Synonym(s)
1.
cannogenin thevetoside
2.
3 beta,14 beta-dihydroxy-19-oxo-5 beta-card-20(22)-enolide-3 alpha-L-thevetoside
3.
encordin
4.
peruvoside
External Link(s)
MeSHC100098
PubChem Compound12314120
ChEBI135825
CHEMBLCHEMBL1075790
DrugBankDB13756
DrugCentral3809
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Myasthenia Gravis3036745CTD
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120239

Copyright © 2019-2020 Laboratory of Molecular Modeling and Design, Shanghai Key Laboratory of New Drug Design, School of Pharmacy, East China University of Science and Technology. All rights reserved.