Chem
J-GLOBAL ID：200907044448420598   Nikkaji number：J1.159.041A

4'-Ethynyl-2'-deoxycytidine

4′-エチニル-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： C11H13N3O4
Molecular formula furigana： C11-H13-N3-O4
Molecular weight： 251.242
InChI： InChI=1S/C11H13N3O4/c1-2-11(6-15)7(16)5-9(18-11)14-4-3-8(12)13-10(14)17/h1,3-4,7,9,15-16H,5-6H2,(H2,12,13,17)/t7-,9+,11+/m0/s1
InChI key： MSPJPGIGNWYLAC-JVUFJMBOSA-N
SMILES： Nc1ccn([C@H]2C[C@H](O)[C@@](CO)(O2)C#C)c(=O)n1
Systematic name  (4)：
  • 4′-エチニル-2′-デオキシシチジン
  • 1-(4-C-エチニル-2-デオキシ-β-D-ribo-ペントフラノシル)シトシン
  • 4-アミノ-1-[(2R,4S,5R)-5-エチニル-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,4S,5R)-5-ethynyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-1,2-dihydropyrimidin-2-one
Other name (4)：
  • 4′-Ethynyl-2′-deoxycytidine
  • 1-(4-C-Ethynyl-2-deoxy-β-D-ribo-pentofuranosyl)cytosine
  • フェスチナビル
  • Festinavir
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