Chem
J-GLOBAL ID：200907060402264724   Nikkaji number：J732.107D

1-(2-Deoxy-4-thio-β-D-erythro-pentofuranosyl)-5-(1-propynyl)uracil

1-(2-デオキシ-4-チオ-β-D-erythro-ペントフラノシル)-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： C12H14N2O4S
Molecular formula furigana： C12-H14-N2-O4-S
Molecular weight： 282.310
InChI： InChI=1S/C12H14N2O4S/c1-2-3-7-5-14(12(18)13-11(7)17)10-4-8(16)9(6-15)19-10/h5,8-10,15-16H,4,6H2,1H3,(H,13,17,18)/t8-,9+,10+/m0/s1
InChI key： XEOVYIZFZHJXQP-IVZWLZJFSA-N
SMILES： CC#Cc1cn([C@H]2C[C@H](O)[C@@H](CO)S2)c(=O)[nH]c1=O
Systematic name  (3)：
  • 1-(2-デオキシ-4-チオ-β-D-erythro-ペントフラノシル)-5-(1-プロピニル)ウラシル
  • 1-[(2R,4S,5R)-4-ヒドロキシ-5-(ヒドロキシメチル)チオラン-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,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]-5-(prop-1-yn-1-yl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1)：
  • 1-(2-Deoxy-4-thio-β-D-erythro-pentofuranosyl)-5-(1-propynyl)uracil
Thsaurus map：
Thesaurus Map

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