General
Preferred name
miquelianin
Synonyms
Quercetin 3-O-glucuronide ()
Quercetin 3-glucuronide ()
Quercetin-3-O-glucuronide ()
QUERCETIN GLUCURONIDE ()
Quercetin 3-O-glucuronide ()
P&D ID
PD057014
CAS
22688-79-5
Tags
nuisance
natural product
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
5
AdooQ Bioactive Compound Library
A21196
Cayman Chemical Bioactives
21289
MedChem Express Bioactive Compound Library
HY-13930
Nuisance compounds in cellular assays
TargetMol Bioactive Compound Library
TQ0188
External IDs
26
Properties
(calculated by RDKit )
Molecular Weight
478.07
Hydrogen Bond Acceptors
12
Hydrogen Bond Donors
8
Rotatable Bonds
4
Ring Count
4
Aromatic Ring Count
3
cLogP
-0.45
TPSA
227.58
Fraction CSP3
0.24
Chiral centers
5.0
Largest ring
6.0
QED
0.22
Structural alerts
1
Nonspecific/NOS
Flavonoid
Nuisance compounds in cellular assays
Custom attributes
(extracted from source data)
Pathway
Metabolism
Metabolic Enzyme/Protease
Target
stilbene oxidase
Endogenous Metabolite
Source data