Chemical Component Summary

Name[2-([2-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)ethyl]{2-[(2-oxoethyl)(2-phosphonoethyl)amino]ethyl}amino)ethyl]phosphonic acid
Identifiers2-[2-(2-azanyl-6-oxidanylidene-1H-purin-9-yl)ethyl-[2-[2-oxidanylideneethyl(2-phosphonoethyl)amino]ethyl]amino]ethylphosphonic acid
FormulaC15 H27 N7 O8 P2
Molecular Weight495.365
TypeNON-POLYMER
Isomeric SMILESc1nc2c(n1CCN(CCN(CCP(=O)(O)O)CC=O)CCP(=O)(O)O)N=C(NC2=O)N
InChIInChI=1S/C15H27N7O8P2/c16-15-18-13-12(14(24)19-15)17-11-22(13)4-3-20(6-9-31(25,26)27)1-2-21(5-8-23)7-10-32(28,29)30/h8,11H,1-7,9-10H2,(H2,25,26,27)(H2,28,29,30)(H3,16,18,19,24)
InChIKeyUVQNMNMHDDJCKT-UHFFFAOYSA-N

Chemical Details

Formal Charge0
Atom Count59
Chiral Atom Count0
Bond Count60
Aromatic Bond Count5

Related Resource References

Resource NameReference
PubChem 135566953, 91757951