948566-12-9 (氟替卡松丙酸酯USP杂质A,Fluticasone 17b-Carbonylsulfenic Acid 17-Propionate)

CAS号:
948566-12-9
中文名称:
氟替卡松丙酸酯USP杂质A
英文名称:
Fluticasone 17b-Carbonylsulfenic Acid 17-Propionate
分子式:
C24H30F2O6S
分子量:
484.553213596344

氟替卡松丙酸酯USP杂质A(948566-12-9)名称与标识符

名称

中文别名:
氟替卡松丙酸酯USP杂质A;氟替卡松17β-羰基次磺酸17-丙酸;D-甘露糖醇-1-13C;氟替卡松杂质B;丙酸氟替卡松杂质B;
英文别名:
Fluticasone Propionate RC A;Fluticasone 17β-Carbonylsulfenic Acid 17-Propionate;[(6S,8S,9R,10S,11S,13S,14S,16R,17R)-6,9-difluoro-11-hydroxy-17-hydroxysulfanylcarbonyl-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate;Androsta-1,4-diene-17-carbo( thioperoxoic) acid, 6,9-difluoro- 11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)-,(6α,11β,16...;Flutione sulfenic acid propionate;UNII-33UEQ4E893;(6α,11β,16α,17α)-6,9-Difluoro-11-hydroxy-16-methyl-3-oxo-17-(1-oxopropoxy)androsta-1,4-diene-17-carbo(thioperoxoic) acid (ACI);Fluticasone Propionate Impurity B;

标识符

InChIKey:
DNPGNKRLBBLSLN-CQRCZTONSA-N
Inchi:
1S/C24H30F2O6S/c1-5-19(29)32-24(20(30)33-31)12(2)8-14-15-10-17(25)16-9-13(27)6-7-21(16,3)23(15,26)18(28)11-22(14,24)4/h6-7,9,12,14-15,17-18,28,31H,5,8,10-11H2,1-4H3/t12-,14+,15+,17+,18+,21+,22+,23+,24+/m1/s1
SMILES:
O([C@@]1([C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(C=C[C@]4(C)[C@]3([C@H](C[C@]12C)O)F)=O)C(=O)SO)C(=O)CC

氟替卡松丙酸酯USP杂质A(948566-12-9)物化性质

实验特性

  • LogP : 3.97600
  • PSA : 126.20000

计算特性

  • 精确分子量 : 484.17300

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氟替卡松丙酸酯USP杂质A(948566-12-9)合成路线

合成路线:1 步
反应条件:
参考文献:
Preparation of novel 11β-hydroxyandrost-4-en-3-ones for therapeutic use as anti-inflammatory agents
, World Intellectual Property Organization, , ,
合成路线:1 步
参考文献:
Preparation of novel 11β-hydroxyandrost-4-en-3-ones for therapeutic use as anti-inflammatory agents
, India, , ,