1-(2-Deoxy-.α.-L-Erythro-Pentofuranosyl)Cytosine

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Formula C9H13N3O4+
IUPAC Name 4-amino-1-[(2r,4r,5s)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one
Molecular Mass 227.217 g·mol−1
Heat of Formation -630.5 ± 16.7 kJ·mol−1
Dipole Moment 3.16 ± 1.08 D
Volume 254.7 Å 3
Surface Area 239.0 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.23 ± eV
Point Group Symmetry C1
Synonyms
  • 4-amino-1-[(2r,4r,5s)-4-hydroxy-5-(hydroxymethyl)-2-tetrahydrofuranyl]-2-pyrimidinone
  • 4-amino-1-[(2r,4r,5s)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,4r,5s)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidin-2-one
  • 4-amino-1-[(2r,4r,5s)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]pyrimidin-2-one
  • erythro-furan-c
InChIKey CKTSBUTUHBMZGZ-GKROBHDKSA-N
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