MetaADEDB 2.0 @ LMMD
prunetin
(KQMVAGISDHMXJJ-UHFFFAOYSA-N)
Structure
SMILES
COc1cc(O)c2c(c1)occ(c2=O)c1ccc(cc1)O
Molecular Formula:
C16H12O5
Molecular Weight:
284.263
Log P:
2.8798
Hydrogen Bond Acceptor:
5
Hydrogen Bond Donor:
2
TPSA:
79.9
CAS Number(s):
552-59-0
Synonym(s)
1.
prunetin
2.
5,4'-dihydroxy-7-methoxyisoflavone
External Link(s)
MeSHC083295
PubChem Compound5281804
BindingDB50359990
ChEBI8600
CHEMBLCHEMBL491174
IUPHAR/BPS Guide to PHARMACOLOGY6919
KEGGcpd:C10521
Therapeutic Target DatabaseD0A9RM
ZINC18847044
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Inflammation23597450CTD
2Sepsis23597450CTD
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.