Chem
J-GLOBAL ID：200907050604445393   Nikkaji number：J732.106F

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

1-(2-デオキシ-4-チオ-β-D-erythro-ペントフラノシル)-5-エチニルウラシル
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： C11H12N2O4S
Molecular formula furigana： C11-H12-N2-O4-S
Molecular weight： 268.290
InChI： InChI=1S/C11H12N2O4S/c1-2-6-4-13(11(17)12-10(6)16)9-3-7(15)8(5-14)18-9/h1,4,7-9,14-15H,3,5H2,(H,12,16,17)/t7-,8+,9+/m0/s1
InChI key： PIJIKFZUICMOIF-DJLDLDEBSA-N
SMILES： OC[C@H]1S[C@H](C[C@@H]1O)n1cc(C#C)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-エチニルウラシル
  • 5-エチニル-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]-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 5-ethynyl-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)thiolan-2-yl]-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1)：
  • 1-(2-Deoxy-4-thio-β-D-erythro-pentofuranosyl)-5-ethynyluracil
Thsaurus map：
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