General
Preferred name
Peonidin 3-O-glucoside (chloride)
Synonyms
Peonidin-3-O-galactoside (chloride) ()
P&D ID
PD070879
CAS
68795-37-9
6906-39-4
28148-89-2
Tags
natural product
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
2
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
53
Properties
(calculated by RDKit )
Molecular Weight
463.12
Hydrogen Bond Acceptors
10
Hydrogen Bond Donors
7
Rotatable Bonds
5
Ring Count
4
Aromatic Ring Count
3
cLogP
0.68
TPSA
180.6
Fraction CSP3
0.32
Chiral centers
5.0
Largest ring
6.0
QED
0.26
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Protein Tyrosine Kinase/RTK
Target
Insulin Receptor
Source data
