Chem
J-GLOBAL ID：201407031164284983   Nikkaji number：J3.231.046J

3′-O-Benzoyl-5′-O-(hydroxyphosphino)thymidine

3′-O-ベンゾイル-5′-O-(ヒドロキシホスフィノ)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： C17H19N2O7P
Molecular formula furigana： C17-H19-N2-O7-P
Molecular weight： 394.320
InChI： InChI=1S/C17H19N2O7P/c1-10-8-19(17(22)18-15(10)20)14-7-12(13(25-14)9-24-27-23)26-16(21)11-5-3-2-4-6-11/h2-6,8,12-14,23,27H,7,9H2,1H3,(H,18,20,22)/t12-,13+,14+/m0/s1
InChI key： NVEXRXNFTCXXBD-BFHYXJOUSA-N
SMILES： Cc1cn([C@H]2C[C@H](OC(=O)c3ccccc3)[C@@H](COPO)O2)c(=O)[nH]c1=O
Systematic name  (3)：
  • 3′-O-ベンゾイル-5′-O-(ヒドロキシホスフィノ)チミジン
  • {[(2R,3S,5R)-3-(ベンゾイルオキシ)-5-(5-メチル-2,4-ジオキソ-1,2,3,4-テトラヒドロピリミジン-1-イル)オキソラン-2-イル]メトキシ}亜ホスフィン酸
  • {[(2R,3S,5R)-3-(benzoyloxy)-5-(5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy}phosphinous acid
Other name (1)：
  • 3′-O-Benzoyl-5′-O-(hydroxyphosphino)thymidine
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