Chem
J-GLOBAL ID:200907058173337017   Nikkaji number:J2.560.804F

RO-0622

4′-アジド-2′β-フルオロ-2′-デオキシシチジン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C9H11FN4[N-][N+]O4
Molecular formula furigana: C9-H11-F-N6-O4
Molecular weight: 286.223
InChI: InChI=1S/C9H11FN6O4/c10-5-6(18)9(3-17,14-15-12)20-7(5)16-2-1-4(11)13-8(16)19/h1-2,5-7,17-18H,3H2,(H2,11,13,19)/t5-,6-,7+,9+/m0/s1
InChI key: KTOLOIKYVCHRJW-XZMZPDFPSA-N
SMILES: Nc1ccn([C@@H]2O[C@@](CO)(N=[N+]=[N-])[C@@H](O)[C@@H]2F)c(=O)n1
Systematic name  (4):
  • 1-(2-フルオロ-4-アジド-2-デオキシ-β-D-アラビノフラノシル)シトシン
  • 4′-アジド-2′β-フルオロ-2′-デオキシシチジン
  • 4-アミノ-1-[(2R,3S,4R,5R)-5-アジド-3-フルオロ-4-ヒドロキシ-5-(ヒドロキシメチル)オキソラン-2-イル]-1,2-ジヒドロピリミジン-2-オン
  • 4-amino-1-[(2R,3S,4R,5R)-5-azido-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one
Other name (3):
  • 1-(2-Fluoro-4-azido-2-deoxy-β-D-arabinofuranosyl)cytosine
  • RO-0622
  • 4′-Azido-2′β-fluoro-2′-deoxycytidine
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