PAP – Adenosine 3',5'-bisphosphate

Name
WID PAP View in model
Name Adenosine 3',5'-bisphosphate View in model
Traditional name [5-(6-aminopurin-9-yl)-4-hydroxy-3-(phosphonatooxy)oxolan-2-yl]methyl phosphate
IUPAC name [5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonatooxy)oxolan-2-yl]methyl phosphate
Cross references CAS: 1053-73-2, ChEBI: 17985, PubChem: 3356, PDBCCD: A3P, ThreeDMET: B01140, ... 4 more
 
Structure
Empirical formula (pH 7.5) H11C10N5O10P2
SMILES (pH 7.5) C1(N=CN=C2(C=1N=CN2C3(OC(C(C3O)OP([O-])([O-])=O)COP([O-])(=O)[O-])))N
Charge (pH 7.5) -4
Is hydrophobic False View in model
Molecular weight (Da) 423.17 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
296.44
ΔfG'o (pH 7.5, 25C, I = 0; kJ mol‑1) -1409.20
pI 2.04
logP -6.35
logD (pH 7.5) -9.36
 
Function
Complex subunit
Reaction participant View in model
 
Metadata
Created 2012-10-01 15:07:05
Last updated 2012-10-01 15:12:27