Chem
J-GLOBAL ID：201407042491367045   Nikkaji number：J3.288.893C

5′-O-[Thiolato[(1-acetylpyrrolidine-2-ylcarbonyl)amino]phosphinyl]-2′,2′-difluoro-2′-deoxycytidine

5′-O-[チオラト[(1-アセチルピロリジン-2-イルカルボニル)アミノ]ホスフィニル]-2′,2′-ジフルオロ-2′-デオキシシチジン
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： C16H21F2N5O7P[S-]
Molecular formula furigana： C16-H21-F2-N5-O7-P-S
Molecular weight： 496.400
InChI： InChI=1S/C16H22F2N5O7PS/c1-8(24)22-5-2-3-9(22)13(26)21-31(28,32)29-7-10-12(25)16(17,18)14(30-10)23-6-4-11(19)20-15(23)27/h4,6,9-10,12,14,25H,2-3,5,7H2,1H3,(H2,19,20,27)(H2,21,26,28,32)/p-1/t9?,10-,12-,14-,31?/m1/s1
InChI key： CROHQJHAAKYLMZ-XVHAHMONSA-M
SMILES： CC(=O)N1CCCC1C(=O)NP(=O)([S-])OC[C@H]1O[C@@H](n2ccc(N)nc2=O)C(F)(F)[C@@H]1O
Systematic name  (3)：
  • 5′-O-[チオラト[(1-アセチルピロリジン-2-イルカルボニル)アミノ]ホスフィニル]-2′,2′-ジフルオロ-2′-デオキシシチジン
  • {[(1-アセチルピロリジン-2-イル)ホルムアミド]({[(2R,3R,5R)-5-(4-アミノ-2-オキソ-1,2-ジヒドロピリミジン-1-イル)-4,4-ジフルオロ-3-ヒドロキシオキソラン-2-イル]メトキシ})ホスホリル}スルファニド
  • {[(1-acetylpyrrolidin-2-yl)formamido]({[(2R,3R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4,4-difluoro-3-hydroxyoxolan-2-yl]methoxy})phosphoryl}sulfanide
Other name (1)：
  • 5′-O-[Thiolato[(1-acetylpyrrolidine-2-ylcarbonyl)amino]phosphinyl]-2′,2′-difluoro-2′-deoxycytidine
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM