MetaADEDB 2.0 @ LMMD
retrorsine
(BCJMNZRQJAVDLD-CQRYIUNCSA-N)
Structure
SMILES
C/C=C\1/C[C@@H](C)[C@](O)(CO)C(=O)OCC2=CCN3[C@H]2[C@H](OC1=O)CC3
Molecular Formula:
C18H25NO6
Molecular Weight:
351.394
Log P:
0.1031
Hydrogen Bond Acceptor:
7
Hydrogen Bond Donor:
2
TPSA:
96.3
CAS Number(s):
480-54-6
Synonym(s)
1.
retrorsine
2.
retrorsine hydrochloride
3.
retrorsine, (15E)-isomer
4.
usaramine
External Link(s)
MeSHC003300
PubChem Compound5281743
ChEBI8822
CHEMBLCHEMBL496894
KEGGcpd:C10364
ZINC96551165
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Chemical and Drug Induced Liver Injury24799337CTD
2Hepatomegaly28095673CTD
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120264

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.