Ap4A

Ligand id: 1732

Name: Ap4A

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 29
Hydrogen bond donors 6
Rotatable bonds 14
Topological polar surface area 484.53
Molecular weight 832.02
XLogP -8.37
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-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphonato}oxy)phosphinato]oxy}phosphinato)oxy]phosphonate
Synonyms
5',5'''-diadenosine tetraphosphate
adenosyl-P4
Ap4A
diadenosine tetraphosphate
Database Links
CAS Registry No. 5542-28-9 (source: Scifinder)
ChEBI CHEBI:58141
Human Metabolome Database HMDB01211
PubChem CID 25243905
Search Google for chemical match using the InChIKey YOAHKNVSNCMZGQ-XPWFQUROSA-J
Search Google for chemicals with the same backbone YOAHKNVSNCMZGQ
Wikipedia Ap4A