[(2R,3S,4S)-5-[3-(2-Blahethoxy)-7,8-Dimethyl-2,4-Dioxo-Benzo[G]Pteridin-10-Ium-1-Id-10-Yl]-2,3,4-Trihydroxy-Pentyl] Dihydrogen Phosphate

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Formula C42H55N9O21PS4+
IUPAC Name [(2r,3s,4s)-5-[3-(2-blahethoxy)-7,8-dimethyl-2,4-dioxo-benzo[g]pteridin-10-ium-1-id-10-yl]-2,3,4-trihydroxy-pentyl] dihydrogen phosphate
Molecular Mass 1181.168 g·mol−1
Heat of Formation -3011.1 ± 16.7 kJ·mol−1
Dipole Moment 9.38 ± 1.08 D
Volume 1214.05 Å 3
Surface Area 1001.31 Å 2
HOMO Energy -7.95 ± 0.55 eV
LUMO Energy -2.04 ± eV
Point Group Symmetry C1
InChIKey AKEFIPOJAGFOPZ-MTSKFENVSA-N
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