ADP ribose

Ligand id: 2444

Name: ADP ribose

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 19
Hydrogen bond donors 8
Rotatable bonds 12
Topological polar surface area 318.98
Molecular weight 559.07
XLogP -6.33
No. Lipinski's rules broken 3

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [hydroxy-[(2R,3R,4R)-2,3,4-trihydroxy-5-oxopentoxy]phosphoryl] hydrogen phosphate
Database Links
CAS Registry No. 20762-30-5 (source: Scifinder)
PubChem CID 30243
Search Google for chemical match using the InChIKey PWJFNRJRHXWEPT-AOOZFPJJSA-N
Search Google for chemicals with the same backbone PWJFNRJRHXWEPT