3-(2-Deoxy-5-O-Phosphonopentofuranosyl)-9-{2-[(Diaminomethylene)Ammonio]Ethoxy}-3H-Pyrimido[5,4-B][1,4]Benzoxazin-2(10H)-One

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Formula C18H24N6O9P+
IUPAC Name diaminomethylene-[2-[[3-[(2r,4s,5r)-5-(dihydroxyphosphoryloxymethyl)-4-hydroxy-tetrahydrofuran-2-yl]-2-oxo-10h-pyrimido[5,4-b][1,4]benzoxazin-9-yl]oxy]ethyl]ammonium
Molecular Mass 499.392 g·mol−1
Heat of Formation 1073.5 ± 16.7 kJ·mol−1
Dipole Moment 3.14 ± 1.08 D
Volume 490.48 Å 3
Surface Area 469.68 Å 2
Point Group Symmetry C1
InChIKey GCBWWBGDWVGEAS-CUOATXAZSA-N
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