c-(2'FdGMP-2'FdAMP)-nucleotide Phosphoramidate

Analyte Name

c-(2'FdGMP-2'FdAMP)-nucleotide Phosphoramidate

Molecular Formula

C20 H24 F2 N12 O9 P2

Molecular Weight

676.424

Accurate Mass

676.123

SMILES

NC1=NC(=O)c2ncn([C@H]3O[C@H]4COP(=O)(O)N[C@@H]5[C@@H](COP(=O)(O)N[C@H]4[C@H]3F)O[C@H]([C@@H]5F)n6cnc7c(N)ncnc67)c2N1

InChI

InChI=1S/C20H24F2N12O9P2/c21-8-10-6(42-18(8)33-4-27-12-14(23)25-3-26-15(12)33)1-40-45(38,39)32-11-7(2-41-44(36,37)31-10)43-19(9(11)22)34-5-28-13-16(34)29-20(24)30-17(13)35/h3-11,18-19H,1-2H2,(H2,23,25,26)(H2,31,36,37)(H2,32,38,39)(H3,24,29,30,35)/t6-,7+,8-,9-,10-,11-,18-,19+/m1/s1

IUPAC

2-amino-9-[(1R,6R,8S,9R,10R,15S,17R,18R)-17-(6-aminopurin-9-yl)-9,18-difluoro-3,12-dihydroxy-3,12-dioxo-4,7,13,16-tetraoxa-2,11-diaza-3?5,12?5-diphosphatricyclo[13.3.0.06,10]octadecan-8-yl]-3H-purin-6-one

Country of Origin

CANADA

Product Format

Neat