Chem
J-GLOBAL ID：200907095779830315   Nikkaji number：J2.295.861E

5′-O-[2-[5-(Dimethylamino)-1-naphthylsulfonylamino]ethoxyphosphonyloxyphosphonyl]cytidine

5′-O-[2-[5-(ジメチルアミノ)-1-ナフチルスルホニルアミノ]エトキシホスホニルオキシホスホニル]シチジン
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： C23H31N5O13P2S
Molecular formula furigana： C23-H31-N5-O13-P2-S
Molecular weight： 679.530
InChI： InChI=1S/C23H31N5O13P2S/c1-27(2)16-7-3-6-15-14(16)5-4-8-18(15)44(36,37)25-10-12-38-42(32,33)41-43(34,35)39-13-17-20(29)21(30)22(40-17)28-11-9-19(24)26-23(28)31/h3-9,11,17,20-22,25,29-30H,10,12-13H2,1-2H3,(H,32,33)(H,34,35)(H2,24,26,31)/t17-,20-,21-,22-/m1/s1
InChI key： OXPWLEWKRGQJQO-BRKWEVRTSA-N
SMILES： CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCOP(=O)(O)OP(=O)(O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ccc(N)nc1=O
Systematic name  (3)：
  • 5′-O-[2-[5-(ジメチルアミノ)-1-ナフチルスルホニルアミノ]エトキシホスホニルオキシホスホニル]シチジン
  • [({[(2R,3S,4R,5R)-5-(4-アミノ-2-オキソ-1,2-ジヒドロピリミジン-1-イル)-3,4-ジヒドロキシオキソラン-2-イル]メトキシ}(ヒドロキシ)ホスホリル)オキシ]({2-[5-(ジメチルアミノ)ナフタレン-1-スルホンアミド]エトキシ})ホスフィン酸
  • [({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]({2-[5-(dimethylamino)naphthalene-1-sulfonamido]ethoxy})phosphinic acid
Other name (1)：
  • 5′-O-[2-[5-(Dimethylamino)-1-naphthylsulfonylamino]ethoxyphosphonyloxyphosphonyl]cytidine
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