(3S)-3-Amino-4-[[3-Aminopropoxy-[[(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy]Phosphoryl]Amino]-4-Oxo-Butanoate

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Formula C17H27N8O9P
IUPAC Name (3s)-3-amino-4-[[3-aminopropoxy-[[(2r,3s,4r,5r)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy]phosphoryl]amino]-4-oxo-butanoic acid
Molecular Mass 518.418 g·mol−1
Heat of Formation -1679.0 ± 16.7 kJ·mol−1
Dipole Moment 3.00 ± 1.08 D
Volume 557.34 Å 3
Surface Area 392.47 Å 2
HOMO Energy -9.08 ± 0.55 eV
LUMO Energy -0.84 ± eV
Point Group Symmetry C1
InChIKey CBRVFFLBHDTTIM-FGNORGMNSA-N
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