[[(2S,3R,4R,5S)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Oxido-Phosphoryl] [(2S,3R,4R)-2,3,4-Trihydroxy-5-(4-Hydroxy-7,8-Dimethyl-2-Oxo-Benzo[G]Pteridin-10-Yl)Pentyl] Phosphate

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Properties Simple | Detailed

Formula C27H37N9O15P2
IUPAC Name [(2r,3s,4r,5r)-5-(6-amino-7h-purin-9-ium-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl [[(2r,3s,4s)-5-(7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentoxy]-hydroxyphosphoryl] hydrogen phosphate
Molecular Mass 789.582 g·mol−1
Heat of Formation -2585.3 ± 16.7 kJ·mol−1
Dipole Moment 4.50 ± 1.08 D
Volume 806.3 Å 3
Surface Area 687.55 Å 2
Point Group Symmetry C1
Synonyms
  • [(2r,3s,4r,5r)-5-(6-amino-7h-purin-9-ium-9-yl)-3,4-dihydroxy-2-tetrahydrofuranyl]methyl [[(2r,3s,4s)-5-(7,8-dimethyl-2,4-dioxo-10-benzo[g]pteridinyl)-2,3,4-trihydroxypentoxy]-hydroxyphosphoryl] hydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-amino-7h-purin-9-ium-9-yl)-3,4-dihydroxy-oxolan-2-yl]methyl [[(2r,3s,4s)-5-(7,8-dimethyl-2,4-dioxo-benzo[g]pteridin-10-yl)-2,3,4-trihydroxy-pentoxy]-hydroxy-phosphoryl] hydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-amino-7h-purin-9-ium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [[(2r,3s,4s)-5-(2,4-diketo-7,8-dimethyl-benzo[g]pteridin-10-yl)-2,3,4-trihydroxy-pentoxy]-hydroxy-phosphoryl] hydrogen phosphate
  • [(2r,3s,4r,5r)-5-(6-amino-7h-purin-9-ium-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [[(2r,3s,4s)-5-(7,8-dimethyl-2,4-dioxo-benzo[g]pteridin-10-yl)-2,3,4-trihydroxy-pentoxy]-hydroxy-phosphoryl] hydrogen phosphate
  • flavin-n7 protonated-adenine dinucleotide
InChIKey VWWQXMAJTJZDQX-UYBVJOGSSA-O
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