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依普利酮中间体 | 95716-70-4

依普利酮中间体
Δ9,11-Eplerenone
95716-70-4
C24H30O5
398.492007732391
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:依普利酮中间体结构式
依普利酮中间体价格
名称和标识符
MDL MFCD11112034
InChIKey GWEKWJOSBYDYDP-DPOGTSLVSA-N
Inchi 1S/C24H30O5/c1-22-8-4-15(25)12-14(22)13-16(21(27)28-3)20-17(22)5-9-23(2)18(20)6-10-24(23)11-7-19(26)29-24/h5,12,16,18,20H,4,6-11,13H2,1-3H3/t16-,18+,20-,22+,23+,24-/m1/s1
SMILES C[C@]12CC=C3[C@]4(CCC(=O)C=C4C[C@H]([C@H]3[C@@H]1CC[C@]12CCC(=O)O1)C(=O)OC)C
别名信息
- 中文别名 -
  • 依普利酮中间体
  • (7a,17a)-17-羟基-3-氧代-孕甾-4,9(11)-二烯-7,21-二羧酸 gamma-内酯甲酯
  • (7α,17α)-17-羟基-3-氧代-孕甾-4,9(11)-二烯-7,21-二羧酸-gammar-内酯甲酯
  • 阿那格雷相关物质A
  • 伊普利酮烯酯
  • 依普利酮中间体(1)
  • 依普利酮中间体2
  • 依普利酮中间体(I)
  • 孕烯羧酸内酯
- 英文别名 -
  • Pregna-4,9(11)-diene-7,21-dicarboxylic acid,17-hydroxy-3-oxo-g-lactone,methyl ester(7a,17a)-
  • Δ9,11-Eplerenone
  • (2'R,7R,8R,10S,13S,14S)-Methyl 10,13-dimethyl-3,5'-dioxo-1,2,3,4',5',6,7,8,10,12,13,14,15,16-tetradecahydro-3'H-spiro[cyclopenta[a]phenanthrene-17,2'-furan]-7-carboxylate
  • (7a,17a)-17-Hydroxy-3-oxo-pregna-4,9(11)-diene-7,21-dicarboxylic acid g-lactone methyl ester
  • Eplerenone intermediate
  • Pregna-4,9(11)-diene-7,21-dicarboxylicacid, 17-hydroxy-3-oxo-, g-lactone, methyl ester, (7a,17a)- (9CI)
  • 7a-(Methoxycarbonyl)-9(11)D-canrenone
  • D9,11-Eplerenone
  • Methyl (8R,10S,13S,14R,17R)-10,13-dimethyl-3,5'-dioxospiro[2,6,7,8,12,14,15,16-octahydro-1H-cyclopen
  • Pregna-4,9(11)-diene-7,21-dicarboxylic acid, 17-hydroxy-3-oxo-, γ-lactone, methyl ester, (7α,17α)- (9CI)
  • 7α-(Methoxycarbonyl)-9(11)Δ-canrenone
  • Δ9,11-Eplerenone
物化性质
实验特性
LogP 3.91330
PSA 69.67000
沸点 580.2°C at 760 mmHg
计算特性
精确分子量 398.20900
氢键供体数量 0
氢键受体数量 5
可旋转化学键数量 2
重原子数量 29
复杂度 869
拓扑分子极性表面积 69.7
海关数据
海关编码 2942000000
海关数据

中国海关编码:

2942000000
合成路线

合成路线:1 步

反应条件:
参考文献:
Process for the preparation of 7α-(methoxycarbonyl)-3-oxo-17α-pregna-4,9(11)-diene-21,17-carbolactone, a useful intermediate for the synthesis of molecules with pharmacological activity
, European Patent Organization, , ,

合成路线:1 步

反应条件:
参考文献:
Process for the preparation of eplerenone from 11α-hydroxycanrenone
, Italy, , ,

合成路线:1 步

反应条件:
参考文献:
A New Approach to the Furan Degradation Problem Involving Ozonolysis of the trans-Enedione and Its Use in a Cost-Effective Synthesis of Eplerenone
Pearlman, Bruce A.; Padilla, Amphlett G.; Hach, John T.; Havens, Jeffrey L.; Pillai, Muniraj D., Organic Letters, 2006, 8(10), 2111-2113

合成路线:1 步

反应条件:
参考文献:
Eplerenone intermediate, preparation method and application in preparation of Eplerenone
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Preparation method of Eplerenone intermediate
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Canrenone derivative, its preparation method and application in synthesis of Eplerenone
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Synthesis and physicochemical characterization of the process-related impurities of eplerenone, an antihypertensive drug
Dams, Iwona; Bialonska, Agata; Cmoch, Piotr; Krupa, Malgorzata; Pietraszek, Anita; et al, Molecules, 2017, 22(8),

合成路线:1 步

反应条件:
参考文献:
Method for synthesizing Eplerenone
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Novel method for preparation of Eplerenone, a steroid-type aldosterone receptor antagonist, with androstenedione
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Environmentally-friendly method for preparing of eplerenone intermediate δ 9,11-eplerenone
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Method for synthesizing 7a-(methylformate)-9(11)-ene canrenone
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Preparation of 7α-cyano-3-oxo-17α-pregn-4,9(11)-dien-21,17-carbolactone and 11α-hydroxy-3-oxo-17α-pregn-4,6-dien-21,17-carbolactone as intermediates in synthesis of eplerenone
, Italy, , ,

合成路线:1 步

反应条件:
参考文献:
A diastereoselective synthesis of 7α-nitromethyl steroid derivative and its use for an efficient synthesis of eplerenone
Zhang, Bin; Chen, Hongli; Tang, Huanyu; Feng, Huijin; Li, Yuanchao, Steroids, 2012, 77(11), 1086-1091

合成路线:1 步

参考文献:
Stereoselective construction of a steroid 5α,7α-oxymethylene derivative and its use in the synthesis of eplerenone
Zhang, Bin; Chen, Hongli; Feng, Huijin; Li, Yuanchao, Steroids, 2011, 76(1-2), 56-59

合成路线:1 步

反应条件:
参考文献:
Preparation of Eplerenone
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Synthesis of Eplerenone from 11α-hydroxycanrenone
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Preparation of eplerenone with high efficiency and low pollution
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Synthesis of selective aldosterone receptor antagonist drug Eplerenone
Chen, Rui; Xu, Yun, Guangzhou Huagong, 2015, 43(3), 82-83

合成路线:1 步

反应条件:
参考文献:
Method for synthesis of steroid medicine Eplerenone
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Preparation of methyl 9α,11α-epoxy-17β-hydroxy-3-oxo-pregn-4-ene-7,21-dicarboxylate γ-lactone (Eplerenone)
, China, , ,
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