MetaADEDB 2.0 @ LMMD
mycophenolic acid glucuronide
(BYFGTSAYQQIUCN-HGIHDBQLSA-N)
Structure
SMILES
COc1c(C/C=C(/CCC(=O)O)\C)c(O[C@@H]2O[C@H](C(=O)O)[C@H]([C@@H]([C@H]2O)O)O)c2c(c1C)COC2=O
Molecular Formula:
C23H28O12
Molecular Weight:
496.461
Log P:
0.2986
Hydrogen Bond Acceptor:
12
Hydrogen Bond Donor:
5
TPSA:
189.28
CAS Number(s):
31528-44-6
Synonym(s)
1.
mycophenolic acid glucuronide
2.
MPAG cpd
3.
mycophenolic acid 7-O-glucuronide
External Link(s)
MeSHC113145
PubChem Compound6442661
ZINC13550000
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Craniofacial Abnormalities22914985CTD
Powered by :

Page last updated at 2020-05-25 10:01:57 (Asia/Shanghai) | You are visitor No. 120269

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.