(2S,3S,4S,5R,6R)-6-{[{[{[(2R,3S,4R,5R)-5-(5-Azido-2,4-Dioxo-3,4-Dihydro-1(2H)-Pyrimidinyl)-3,4-Dihydroxytetrahydro-2-Furanyl]Methoxy}(Hydroxy)Phosphoryl]Oxy}(Hydroxy)(~32~P)Phosphoryl]Oxy}-3,4,5-Trihydroxytetrahydro-2H-Pyran-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C15H12N5O18P2
IUPAC Name [[(2r)-2-[(1r)-1-[2-azidoethynyl(carbonisocyanatidoyl)amino]-2-oxo-ethoxy]-3-oxo-propoxy]-oxido-phosphoryl] [1-(2,3-dioxopropoxy)-2-oxo-vinyl] phosphate; carbon dioxide
Molecular Mass 612.226 g·mol−1
Heat of Formation -3496.1 ± 16.7 kJ·mol−1
Dipole Moment 8.37 ± 1.08 D
Volume 599.88 Å 3
Surface Area 476.66 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy -1.63 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4s,5r,6r)-6-[[[(2r,3s,4r,5r)-5-(5-azido-2,4-diketo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
  • (2s,3s,4s,5r,6r)-6-[[[(2r,3s,4r,5r)-5-(5-azido-2,4-dioxo-1-pyrimidinyl)-3,4-dihydroxy-2-tetrahydrofuranyl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4,5-trihydroxy-2-tetrahydropyrancarboxylic acid
  • (2s,3s,4s,5r,6r)-6-[[[(2r,3s,4r,5r)-5-(5-azido-2,4-dioxo-pyrimidin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-3,4,5-trihydroxy-oxane-2-carboxylic acid
  • (2s,3s,4s,5r,6r)-6-[[[(2r,3s,4r,5r)-5-(5-azido-2,4-dioxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]oxy-hydroxy-phosphoryl]oxy-3,4,5-trihydroxy-tetrahydropyran-2-carboxylic acid
  • (2s,3s,4s,5r,6r)-6-[[[(2r,3s,4r,5r)-5-(5-azido-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
  • 5-azido-udp-glucuronic acid
  • alpha-d-glucopyranuronic acid, 1-p-ester with 5-azidouridine 5'-(trihydrogen diphosphate-p'-32p)
  • alpha-d-glucopyranuronic acid, 1-p-ester with 5-azidouridine 5'-(trihydrogendiphosphate-p'-32p)
CAS Number(s)
  • 137528-00-8
InChIKey ZNOHGZBJCYOZKN-NQZRZOHOSA-N
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