19914-67-1 (13-乙基-17Β-羟基-18,19-二去甲孕甾-5(10)-烯-20-炔-3-酮 17Α-乙炔基-17Β-羟基-18-甲基雌甾-5(10)-烯-3-酮,13-Ethyl-17-hydroxy-18,19-dinor-17a-pregn-5(10)-en-20-yn-3-one(Levo Norgestrel Impurity))

CAS号:
19914-67-1
中文名称:
13-乙基-17Β-羟基-18,19-二去甲孕甾-5(10)-烯-20-炔-3-酮 17Α-乙炔基-17Β-羟基-18-甲基雌甾-5(10)-烯-3-酮
英文名称:
13-Ethyl-17-hydroxy-18,19-dinor-17a-pregn-5(10)-en-20-yn-3-one(Levo Norgestrel Impurity)
分子式:
C21H28O2
分子量:
312.445826530457

13-乙基-17Β-羟基-18,19-二去甲孕甾-5(10)-烯-20-炔-3-酮 17Α-乙炔基-17Β-羟基-18-甲基雌甾-5(10)-烯-3-酮(19914-67-1)名称与标识符

名称

中文别名:
13-乙基-17Β-羟基-18,19-二去甲孕甾-5(10)-烯-20-炔-3-酮 17Α-乙炔基-17Β-羟基-18-甲基雌甾-5(10)-烯-3-酮;(8R,13S,17R)-13-乙基-17-乙炔基-17-羟基-1,2,4,6,7,8,9,11,12,13,14,15,16,17-十四氢-3H-环戊二烯并[a]菲-3-酮;乙基雌烯酮;左炔诺孕酮杂质B;17Α-乙炔基-18-甲基雌甾-5(10)-烯-17Β-醇-3-酮;13-乙基-17Β-羟基-18,19-二去甲孕甾-5(10)-烯-20-炔-3-酮 17Alpha-乙炔基-17Β-羟基-18-甲基雌甾-5(10)-烯-3-酮;
英文别名:
18,19-Dinorpregn-5(10)-en-20-yn-3-one,13-ethyl-17-hydroxy-, (17a)- (9CI);13-Ethyl-17-hydroxy-18,19-dinorpregn-5(10)-en-20-yn-3-one;13-Ethyl-17-hydroxy-18,19-dinor-17α-pregn-5(10)-en-20-yn-3-one;13-ETHYL-17-HYDROXY-18,19-DINOR-17Α-PREGN-5(10)-EN-20-YN-3-ONE (LEVO NORGESTREL IMPURITY);13-Ethyl-17-hydroxy-18,19-dinor-17α-pregn-5(10)-en-20-yn-3-one (Levo Norgestrel Impurity);(8R,9S,13S,14S,17R)-13-ethyl-17-ethynyl-17-hydroxy-1,2,4,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one;13-Ethyl-17-hydroxy-18,19-dinor-17-α-pregn-5(10)-en-20-yn-3-one;Levonorgestrel impurity B;17-Ethinyl-17-hydroxy-18-methylestr-5(10)-en-3-one;EP Levonorgestrel Impurity B;Levonorgestrel EP impurity B;13-Ethyl-17α-ethynyl-17-hydroxygon-5(10)-en-3-one;13-Ethyl-17a-ethynyl-17-hydroxygon-5(10)-en-3-one;(17α)-13-Ethyl-17-hydroxy-18,19-dinorpregn-5(10)-en-20-yn-3-one;13-Ethyl-17-hydroxy-18,19-dinor-17α-pregn-5(10)-en-20-yn-3-one(Levonorgestrel Impurity B);13-Ethyl-17-hydroxy-18,19-dinor-17a-pregn-5(10)-en-20-yn-3-one (Levo Norgestrel IMpurity);(8R,9S,13S,14S,17R)-13-Ethyl-17-ethynyl-17-hydroxy-1,2,4,6,7,8,9,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one (non-preferred name);13-ETHYL-17-HYDROXY-18,19-DINOR-17.ALPHA.-PREGN-5(10)-EN-20-YN-3-ONE;13-Ethyl-17-hydroxy-18,19-dinor-17alpha-pregn-5(10)-en-20-yn-3-one;DTXSID80652581;18,19-DINORPREGN-5(10)-EN-20-YN-3-ONE, 13-ETHYL-17-HYDROXY-, (17.ALPHA.)-;E8SU3M53QV;CID 29979902;(17alpha)-13-Ethyl-17-hydroxy-18,19-dinorpregn-5(10)-en-20-yn-3-one;QCMLVDXPKCBMFQ-MJCUULBUSA-N;SCHEMBL11856287;13-Ethyl-17-hydroxy-18,19-dinor-17?-pregn-5(10)-en-20-yn-3-one;Levonoregestrel impurity B [EP];13-Ethyl-17-hydroxy-18,19-dinor-17Alpha-pregn-5(10)-en-20-yn-3-one(Levo Norgestrel Impurity);(17.ALPHA.)-13-ETHYL-17-HYDROXY-18,19-DINORPREGN-5(10)-EN-20-YN-3-ONE;19914-67-1;LEVONOREGESTREL IMPURITY B [EP IMPURITY];18,19-Dinorpregn-5(10)-en-20-yn-3-one, 13-ethyl-17-hydroxy-, (17alpha)-;13beta-ethyl-17alpha-ethynyl-17beta-hydroxy-gon-5(10)-en-3-one;UNII-E8SU3M53QV;(8R,9S,13S,14S,17R)-13-Ethyl-17-ethynyl-17-hydroxy-1,2,4,6,7,8,9,11,12,13,14,15,16,17-tetradecahydro-3H-cyclopenta[a]phenanthren-3-one;(17a)-13-ethyl-17-hydroxy-18,19-Dinorpregn-5(10)-en-20-yn-3-one; 18,19-Dinor-17a-pregn-5(10)-en-20-yn-3-one, 13-ethyl-17-hydroxy- (7CI,8CI); 13-Ethyl-17a-ethynyl-17-hydroxygon-5(10)-en-3-one; Levonorgestrel Imp. B (EP);

标识符

InChIKey:
QCMLVDXPKCBMFQ-MJCUULBUSA-N
Inchi:
1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,17-19,23H,3,5-13H2,1H3/t17-,18-,19+,20+,21+/m1/s1
SMILES:
O[C@@]1(C#C)CC[C@H]2[C@@H]3CCC4CC(CCC=4[C@H]3CC[C@@]21CC)=O

13-乙基-17Β-羟基-18,19-二去甲孕甾-5(10)-烯-20-炔-3-酮 17Α-乙炔基-17Β-羟基-18-甲基雌甾-5(10)-烯-3-酮(19914-67-1)物化性质

实验特性

  • LogP : 4.14970
  • PSA : 37.30000
  • 折射率 : 1.572
  • 熔点 : 169-171?C

计算特性

  • 精确分子量 : 313.21700
  • 氢键供体数量 : 1
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 2
  • 同位素质量 : 312.208930132g/mol
  • 重原子数量 : 23
  • 复杂度 : 621
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 5
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 2.5
  • 拓扑分子极性表面积 : 37.3Ų

13-乙基-17Β-羟基-18,19-二去甲孕甾-5(10)-烯-20-炔-3-酮 17Α-乙炔基-17Β-羟基-18-甲基雌甾-5(10)-烯-3-酮(19914-67-1)安全信息

13-乙基-17Β-羟基-18,19-二去甲孕甾-5(10)-烯-20-炔-3-酮 17Α-乙炔基-17Β-羟基-18-甲基雌甾-5(10)-烯-3-酮(19914-67-1)推荐厂家 更多厂家(9)

公司名称手机号/电话联系人QQ微信询单
上海源叶生物科技有限公司 15026964105
15026964105
汤思磊 2881489226
询单
湖北扬信医药科技有限公司 13092795037
0714-3996388
熊磊 3003473323
询单
湖北扬信医药科技有限公司 18071854684
0714-3999001
程舒畅 2885409691
询单
深圳振强生物技术有限公司 13670046396
86-755-66853366
颜经理 2851296953
询单
上海瀚思化工有限公司 18939883912
021-34536277
顾经理 3003949364
询单
深圳市中发源生物科技有限公司 18129803827
0755-23105005
林小姐 3158423203
询单
南兴化工(江苏)有限公司 18651116180
0512-66387035
闵慧萍 3771156959 询单
上海柯维化学技术有限公司 18901607656
021-64609169
白荷 3428632096 询单
上海博顿生物化工有限公司 13391276129
021-59996125
余伟 1850007935 询单

13-乙基-17Β-羟基-18,19-二去甲孕甾-5(10)-烯-20-炔-3-酮 17Α-乙炔基-17Β-羟基-18-甲基雌甾-5(10)-烯-3-酮(19914-67-1)参考资料

Reaxys RN:
PubChem CID: