Chem
J-GLOBAL ID:200907083324991819   Nikkaji number:J732.108B

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

1-(2-デオキシ-4-チオ-β-D-erythro-ペントフラノシル)-5-(2-メトキシエチル)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: C12H18N2O5S
Molecular formula furigana: C12-H18-N2-O5-S
Molecular weight: 302.350
InChI: InChI=1S/C12H18N2O5S/c1-19-3-2-7-5-14(12(18)13-11(7)17)10-4-8(16)9(6-15)20-10/h5,8-10,15-16H,2-4,6H2,1H3,(H,13,17,18)/t8-,9+,10+/m0/s1
InChI key: CXABUDHJCQJYBR-IVZWLZJFSA-N
SMILES: COCCc1cn([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-(2-メトキシエチル)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-(2-メトキシエチル)-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-(2-methoxyethyl)-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1):
  • 1-(2-Deoxy-4-thio-β-D-erythro-pentofuranosyl)-5-(2-methoxyethyl)uracil
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