GFC

5'-O-[(S)-{[(S)-[(S)-chloro(fluoro)phosphonomethyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-2'-deoxyguanosine


Toggle HydrogenToggle Labels

Chemical Component Summary

Name5'-O-[(S)-{[(S)-[(S)-chloro(fluoro)phosphonomethyl](hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-2'-deoxyguanosine
Identifiers[(S)-[[[(2R,3S,5R)-5-(2-azanyl-6-oxo-1H-purin-9-yl)-3-hydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]-chloro-fluoro-methyl]phosphonic acid
FormulaC11 H16 Cl F N5 O12 P3
Molecular Weight557.644
TypeNON-POLYMER
Isomeric SMILESc1nc2c(n1[C@H]3C[C@@H]([C@H](O3)CO[P@](=O)(O)O[P@](=O)([C@](F)(P(=O)(O)O)Cl)O)O)N=C(NC2=O)N
InChIInChI=1S/C11H16ClFN5O12P3/c12-11(13,31(21,22)23)32(24,25)30-33(26,27)28-2-5-4(19)1-6(29-5)18-3-15-7-8(18)16-10(14)17-9(7)20/h3-6,19H,1-2H2,(H,24,25)(H,26,27)(H2,21,22,23)(H3,14,16,17,20)/t4-,5+,6+,11+/m0/s1
InChIKeyYYWHXOYNXRQZKR-XUSYNCDOSA-N

Chemical Details

Formal Charge0
Atom Count49
Chiral Atom Count4
Bond Count51
Aromatic Bond Count5

Related Resource References

Resource NameReference
PubChem 135566495, 45480165