Chem
J-GLOBAL ID：200907077522049932   Nikkaji number：J660.966J

AR-C-67085

AR-C-67085
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： C14H22Cl2N5O12P3S
Molecular formula furigana： C14-H22-CL2-N5-O12-P3-S
Molecular weight： 648.230
InChI： InChI=1S/C14H22Cl2N5O12P3S/c1-2-3-37-13-19-10(17)7-11(20-13)21(5-18-7)12-9(23)8(22)6(32-12)4-31-36(29,30)33-35(27,28)14(15,16)34(24,25)26/h5-6,8-9,12,22-23H,2-4H2,1H3,(H,27,28)(H,29,30)(H2,17,19,20)(H2,24,25,26)/t6-,8-,9-,12-/m1/s1
InChI key： ZLIAJZQKKBOFJR-WOUKDFQISA-N
SMILES： CCCSc1nc(N)c2ncn([C@@H]3O[C@H](COP(=O)(O)OP(=O)(O)C(Cl)(Cl)P(=O)(O)O)[C@@H](O)[C@H]3O)c2n1
Systematic name  (5)：
  • ホスホノジクロロメチルイソ次りん酸Oα-[2-(プロピルチオ)-5′-アデノシル]
  • 2-(プロピルチオ)アデノシン5′-りん酸ホスホノジクロロメチルホスホニル
  • 2-(プロピルチオ)-5′-O-[[(ジクロロホスホノメチル)ホスホニルオキシ]ホスホニル]アデノシン
  • ({[({[(2R,3S,4R,5R)-5-[6-アミノ-2-(プロピルスルファニル)-9H-プリン-9-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](ヒドロキシ)ホスホリル}ジクロロメチル)ホスホン酸
  • ({[({[(2R,3S,4R,5R)-5-[6-amino-2-(propylsulfanyl)-9H-purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}dichloromethyl)phosphonic acid
Other name (7)：
  • FPL-67085XX
  • Phosphonodichloromethylisohypodiphosphoric acid Oα-[2-(propylthio)-5′-adenosyl] ester
  • FPL-67085
  • 2-(Propylthio)adenosine 5′-phosphoric acid phosphonodichloromethylphosphonyl ester
  • 2-(Propylthio)-5′-O-[[(dichlorophosphonomethyl)phosphonyloxy]phosphonyl]adenosine
Show all
CAS registry number： 164992-25-0
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM