[(20S,21R,22R)-5-[[19-Amino-5-[Formyl-[(23R,24R,25R,26S)-24-Hydroxy-9-Methoxy-18,27-Dioxo-42,43,45-Trioxapentacyclo[Blah.Blah.Blah.Blah.Blah.Blah]Nonadeca-2(9),8(12),10(13),11(15)-Tetraen-25-Yl]Amino]-16-Oxo-1H-Pyrimidin-17-Yl]Amino]-3-Hydroxy-Tetrahydrofuran-22-Yl]Methyl Dihydrogen Phosphate

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Formula C27H28N5O15P
IUPAC Name [(20s,21r,22r)-5-[[19-amino-5-[formyl-[(23r,24r,25r,26s)-24-hydroxy-9-methoxy-18,27-dioxo-42,43,45-trioxapentacyclo[blah.blah.blah.blah.blah.blah]nonadeca-2(9),8(12),10(13),11(15)-tetraen-25-yl]amino]-16-oxo-1h-pyrimidin-17-yl]amino]-3-hydroxy-tetrahydrofuran-22-yl]methyl dihydrogen phosphate
Molecular Mass 693.509 g·mol−1
Heat of Formation -2676.2 ± 16.7 kJ·mol−1
Dipole Moment 15.78 ± 1.08 D
Volume 703.79 Å 3
Surface Area 487.36 Å 2
HOMO Energy -8.88 ± 0.55 eV
LUMO Energy -1.21 ± eV
Point Group Symmetry C1
InChIKey ATYDIVLPRYGUHN-MHRKVAGWSA-N
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