(2R,3R,4R,5S)-5-[(1R)-2-Amino-1-{[(2S,3S,4S)-3,4-Dihydroxy-6-{[(3S)-2-Oxo-3-Azepanyl]Carbamoyl}-3,4-Dihydro-2H-Pyran-2-Yl]Oxy}-2-Oxoethyl]-2-(2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-4-Methoxytetrahydro-3-Furanyl Carbamate

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Formula C24H32N6O13++
IUPAC Name [(2r,3r,4r,5s)-5-[(1r)-2-amino-1-[[(2s,3s,4s)-3,4-dihydroxy-6-[[(3s)-2-oxoazepan-3-yl]carbamoyl]-3,4-dihydro-2h-pyran-2-yl]oxy]-2-oxo-ethyl]-2-(2,4-dioxopyrimidin-1-yl)-4-methoxy-tetrahydrofuran-3-yl] carbamate
Molecular Mass 612.543 g·mol−1
Heat of Formation -2206.7 ± 16.7 kJ·mol−1
Dipole Moment 9.03 ± 1.08 D
Volume 674.68 Å 3
Surface Area 498.48 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy -0.66 ± eV
Point Group Symmetry C1
InChIKey LFWCXMYKHTWICM-YSJZXXSHSA-N
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