4-{[(4Ar,6R,7R,7Ar)-6-(2-Amino-6-Oxo-3,6-Dihydro-9H-Purin-9-Yl)-2-Hydroxy-2-Oxidotetrahydro-4H-Furo[3,2-D][1,3,2]Dioxaphosphinin-7-Yl]Oxy}-4-Oxobutanoic Acid

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Properties Simple | Detailed

Formula C14H16N5O10P
IUPAC Name 4-[[(2s,4ar,6r,7r,7ar)-6-(2-amino-6-oxo-3h-purin-9-yl)-2-hydroxy-2-oxo-4a,6,7,7a-tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-yl]oxy]-4-oxo-butanoic acid
Molecular Mass 445.278 g·mol−1
Heat of Formation -1724.3 ± 16.7 kJ·mol−1
Dipole Moment 8.19 ± 1.08 D
Volume 444.86 Å 3
Surface Area 381.73 Å 2
HOMO Energy -9.36 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C1
Synonyms
  • 2'-o-succinyl cyclic gmp
  • 4-[[(1r,6r,8r,9r)-8-(2-amino-6-keto-3h-purin-9-yl)-3-hydroxy-3-keto-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-9-yl]oxy]-4-keto-butyric acid
  • 4-[[(1r,6r,8r,9r)-8-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-9-yl]oxy]-4-oxo-butanoic acid
  • 4-[[(1r,6r,8r,9r)-8-(2-amino-6-oxo-3h-purin-9-yl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-9-yl]oxy]-4-oxobutanoic acid
  • guanosine cyclic 3',5'-(hydrogen phosphate) 2'-(3-carboxypropanoate)
  • guanosine cyclic 3',5'-(hydrogen phosphate) 2'-(hydrogen succinate)
CAS Number(s)
  • 39118-26-8
InChIKey JXBAIDPTIVEYLH-MSTPSEHLSA-N
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