Chem
J-GLOBAL ID:200907036762427634   Nikkaji number:J689.980C

N-Methyl-N-[2-(tosyloxy)ethyl]amidophosphoric acid 3′-O-(tert-butyldimethylsilyl)-5-fluoro-2′-deoxy-5′-uridyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)ethyl ester

N-メチル-N-[2-(トシルオキシ)エチル]アミドりん酸3′-O-(tert-ブチルジメチルシリル)-5-フルオロ-2′-デオキシ-5′-ウリジル2-(2,2-ジメチル-1,3-ジオキソラン-4-イル)エチル
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: C32H51FN3O12PSSi
Molecular formula furigana: C32-H51-F-N3-O12-P-S-SI
Molecular weight: 779.890
InChI: InChI=1S/C32H51FN3O12PSSi/c1-22-10-12-24(13-11-22)50(40,41)45-17-15-35(7)49(39,43-16-14-23-20-42-32(5,6)47-23)44-21-27-26(48-51(8,9)31(2,3)4)18-28(46-27)36-19-25(33)29(37)34-30(36)38/h10-13,19,23,26-28H,14-18,20-21H2,1-9H3,(H,34,37,38)/t23?,26-,27+,28+,49?/m0/s1
InChI key: XRTXCXIEXOCCFC-UGNJTPCBSA-N
SMILES: CN(CCOS(=O)(=O)c1ccc(C)cc1)P(=O)(OCCC1COC(C)(C)O1)OC[C@H]1O[C@H](C[C@@H]1O[Si](C)(C)C(C)(C)C)n1cc(F)c(=O)[nH]c1=O
Systematic name  (3):
  • N-メチル-N-[2-(トシルオキシ)エチル]アミドりん酸3′-O-(tert-ブチルジメチルシリル)-5-フルオロ-2′-デオキシ-5′-ウリジル2-(2,2-ジメチル-1,3-ジオキソラン-4-イル)エチル
  • 1-[(2R,4S,5R)-4-[(tert-ブチルジメチルシリル)オキシ]-5-[({[2-(2,2-ジメチル-1,3-ジオキソラン-4-イル)エトキシ][メチル({2-[(4-メチルベンゼンスルホニル)オキシ]エチル})アミノ]ホスホリル}オキシ)メチル]オキソラン-2-イル]-5-フルオロ-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-[(tert-butyldimethylsilyl)oxy]-5-[({[2-(2,2-dimethyl-1,3-dioxolan-4-yl)ethoxy][methyl({2-[(4-methylbenzenesulfonyl)oxy]ethyl})amino]phosphoryl}oxy)methyl]oxolan-2-yl]-5-fluoro-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (1):
  • N-Methyl-N-[2-(tosyloxy)ethyl]amidophosphoric acid 3′-O-(tert-butyldimethylsilyl)-5-fluoro-2′-deoxy-5′-uridyl 2-(2,2-dimethyl-1,3-dioxolan-4-yl)ethyl ester
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