MetaADEDB 2.0 @ LMMD
alpha-chaconine
(TYNQWWGVEGFKRU-AJDPQWBVSA-N)
Structure
SMILES
OC[C@H]1O[C@@H](O[C@H]2CC[C@]3(C(=CC[C@@H]4[C@@H]3CC[C@]3([C@H]4C[C@H]4[C@@H]3[C@H](C)[C@@H]3N4C[C@H](CC3)C)C)C2)C)[C@@H]([C@H]([C@@H]1O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O)O)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O
Molecular Formula:
C45H73NO14
Molecular Weight:
852.059
Log P:
1.1207
Hydrogen Bond Acceptor:
15
Hydrogen Bond Donor:
8
TPSA:
220.46
CAS Number(s):
20562-03-2
Synonym(s)
1.
alpha-chaconine
2.
conine
External Link(s)
MeSHC011860
PubChem Compound442971
ChEBI10219
KEGGcpd:C10796
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Sepsis25913072CTD
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120263

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.