Chem
J-GLOBAL ID:200907078044816244   Nikkaji number:J1.684.627I

5′-Cytidyloxyphosphonylmethylphosphonyloxyphosphonic acid

5′-シチジルオキシホスホニルメチルホスホニルオキシホスホン酸
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: C10H18N3O13P3
Molecular formula furigana: C10-H18-N3-O13-P3
Molecular weight: 481.183
InChI: InChI=1S/C10H18N3O13P3/c11-6-1-2-13(10(16)12-6)9-8(15)7(14)5(25-9)3-24-27(17,18)4-28(19,20)26-29(21,22)23/h1-2,5,7-9,14-15H,3-4H2,(H,17,18)(H,19,20)(H2,11,12,16)(H2,21,22,23)/t5-,7-,8-,9-/m1/s1
InChI key: STGUOVSTMBLHFT-ZOQUXTDFSA-N
SMILES: Nc1ccn([C@@H]2O[C@H](COP(=O)(O)CP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)n1
Systematic name  (3):
  • 5′-シチジルオキシホスホニルメチルホスホニルオキシホスホン酸
  • ({[({[(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)メチル](ヒドロキシ)ホスホリル}オキシ)ホスホン酸
  • ({[({[(2R,3S,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)methyl](hydroxy)phosphoryl}oxy)phosphonic acid
Other name (1):
  • 5′-Cytidyloxyphosphonylmethylphosphonyloxyphosphonic acid
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