Chem
J-GLOBAL ID：200907016264850979   Nikkaji number：J2.446.586A

2′α,4′-(Oxycarbonyliminomethylene)thymidine

2′α,4′-(オキシカルボニルイミノメチレン)チミジン
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： C12H15N3O7
Molecular formula furigana： C12-H15-N3-O7
Molecular weight： 313.266
InChI： InChI=1S/C12H15N3O7/c1-5-2-15(10(19)14-8(5)18)9-6-7(17)12(4-16,22-9)3-13-11(20)21-6/h2,6-7,9,16-17H,3-4H2,1H3,(H,13,20)(H,14,18,19)/t6-,7+,9-,12-/m1/s1
InChI key： SSJRVRASIKKXHL-MCOZSMFQSA-N
SMILES： Cc1cn([C@@H]2O[C@@]3(CO)CNC(=O)O[C@@H]2[C@@H]3O)c(=O)[nH]c1=O
Systematic name  (3)：
  • 2′α,4′-(オキシカルボニルイミノメチレン)チミジン
  • 1-[(1R,6R,8R,9S)-9-ヒドロキシ-6-(ヒドロキシメチル)-3-オキソ-2,7-ジオキサ-4-アザビシクロ[4.2.1]ノナン-8-イル]-5-メチル-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 1-[(1R,6R,8R,9S)-9-hydroxy-6-(hydroxymethyl)-3-oxo-2,7-dioxa-4-azabicyclo[4.2.1]nonan-8-yl]-5-methyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1)：
  • 2′α,4′-(Oxycarbonyliminomethylene)thymidine
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