MetaADEDB 2.0 @ LMMD
gedunin
(YJXDGWUNRYLINJ-BHAPSIHVSA-N)
Structure
SMILES
CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@@]2([C@@H]2[C@]1(C)[C@@]13O[C@@H]1C(=O)O[C@H]([C@@]3(CC2)C)c1ccoc1)C
Molecular Formula:
C28H34O7
Molecular Weight:
482.565
Log P:
4.5607
Hydrogen Bond Acceptor:
7
Hydrogen Bond Donor:
0
TPSA:
95.34
CAS Number(s):
2753-30-2
Synonym(s)
1.
gedunin
External Link(s)
MeSHC106014
PubChem Compound12004512
ChEBI65954
CHEMBLCHEMBL465226
ZINC3978117
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Neurotoxicity Syndromes29471019CTD
2leukemia21381696CTD
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.