Chem
J-GLOBAL ID:200907017558468041   Nikkaji number:J723.821E

1-(2-Methyl-2-deoxy-β-D-arabinofuranosyl)-5-(1-propynyl)uracil

1-(2-メチル-2-デオキシ-β-D-アラビノフラノシル)-5-(1-プロピニル)ウラシル
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: C13H16N2O5
Molecular formula furigana: C13-H16-N2-O5
Molecular weight: 280.280
InChI: InChI=1S/C13H16N2O5/c1-3-4-8-5-15(13(19)14-11(8)18)12-7(2)10(17)9(6-16)20-12/h5,7,9-10,12,16-17H,6H2,1-2H3,(H,14,18,19)/t7-,9+,10-,12+/m0/s1
InChI key: VFHBEBUSFBIMLX-NCIFOGHDSA-N
SMILES: CC#Cc1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2C)c(=O)[nH]c1=O
Systematic name  (3):
  • 1-(2-メチル-2-デオキシ-β-D-アラビノフラノシル)-5-(1-プロピニル)ウラシル
  • 1-[(2R,3S,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)-3-メチルオキソラン-2-イル]-5-(プロパ-1-イン-1-イル)-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 1-[(2R,3S,4S,5R)-4-hydroxy-5-(hydroxymethyl)-3-methyloxolan-2-yl]-5-(prop-1-yn-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1):
  • 1-(2-Methyl-2-deoxy-β-D-arabinofuranosyl)-5-(1-propynyl)uracil
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