钙泊三醇中间体-9

CAS号
112849-17-9
CCD编号
CCD00817053
分子式
C39 H66 O3 Si2
分子量
639.119

基本信息

产品名称: 钙泊三醇中间体-9
CAS: 112849-17-9
中文同义词: 钙泊三醇中间体-9
英文同义词: 2-PENTEN-1-ONE, 4-[(1R,3AS,4E,7AR)-4-[(2E)-2-[(3S,5R)-3,5-BIS[[(1,1-DIMETHYLETHYL)DIMETHYLSILYL]OXY]-2-METHYLENECYCLOHEXYLIDENE]ETHYLIDENE]OCTAHYDRO-7A-METHYL-1H-INDEN-1-YL]-1-CYCLOPROPYL-, (2E,4R)- ; (1ALPHA,3BETA,5E,7E,22E)-24-CYCLOPROPYL-1,3-BIS(((1,1-DIMETHYLETHYL)DIMETHYLSILYL)OXY)-9,10-SECOCHOLA-5,7,10(19),22-TETRAEN-24-ONE ; 1(S),3(R),20(R)-BIS(TERT-BUTYLDIMETHYLSILYLOXY)-20-(3'-CYCLOPROPYL-3'-OXYPROP-1'(E)-ENYL)-9,10-SECOPREGNA-5(E),10(19)TRIENE ; (2E,4R)-4-[(1R,3AS,4E,7AR)-4-[(2E)-2-[(3S,5R)-3,5-BIS[[(TERT-BUTYL)DIMETHYLSILYL]OXY]-2-METHYLENECYCLOHEXYLIDENE]ETHYLIDENE]OCTAHYDRO-7A-METHYL-1H-INDEN-1-YL]-1-CYCLOPROPYL-2-PENTEN-1-ONE
MDL号: MFCD09833393
氢键受体数量: 3
氢键供体数量: 0
Smile: C[C@H](/C=C/C(=O)C1CC1)[C@H]2CCC\3[C@@]2(CCC/C3=C\C=C\4/C[C@H](C[C@@H](C4=C)O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C
InChi: InChI=1S/C39H66O3Si2/c1-27(16-23-35(40)30-18-19-30)33-21-22-34-29(15-14-24-39(33,34)9)17-20-31-25-32(41-43(10,11)37(3,4)5)26-36(28(31)2)42-44(12,13)38(6,7)8/h16-17,20,23,27,30,32-34,36H,2,14-15,18-19,21-22,24-26H2,1,3-13H3/b23-16+,29-17+,31-20+/t27-,32-,33-,34?,36+,39-/m1/s1
InChiKey: InChIKey=OOEFJWPTKXCMDU-BBACPOOOSA-N

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