Formycin A

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Properties Simple | Detailed

Formula C10H13N5O4
IUPAC Name (2s,3r,4s,5r)-2-(7-aminopyrazolo[4,3-d]pyrimidin-1-ium-7a-ylium-3-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
Molecular Mass 267.241 g·mol−1
Heat of Formation -394.6 ± 16.7 kJ·mol−1
Dipole Moment 5.66 ± 1.08 D
Volume 285.5 Å 3
Surface Area 257.93 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -1.25 ± eV
Point Group Symmetry C1
Synonyms
  • (1s)-1-(7-amino-1h-pyrazolo[4,3-d]pyrimidin-3-yl)-1,4-anhydro-d-ribitol
  • (2s,3r,4s,5r)-2-(7-amino-2h-pyrazolo[5,4-e]pyrimidin-3-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diol
  • (2s,3r,4s,5r)-2-(7-amino-2h-pyrazolo[5,4-e]pyrimidin-3-yl)-5-methylol-tetrahydrofuran-3,4-diol
  • d-ribitol, 1-c-(7-amino-1h-pyrazolo[4,3-d]pyrimidin-3-yl)-1,4-anhydro-,(1s)-
  • fmc
  • formycin
CAS Number(s)
  • 6742-12-7
InChIKey KBHMEHLJSZMEMI-KSYZLYKTSA-N
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