Chem
J-GLOBAL ID：200907021221555721   Nikkaji number：J1.763.236A

3-(tert-Butyldimethylsiloxy)-17-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)estra-1,3,5(10),16-tetrene

3-(tert-ブチルジメチルシロキシ)-17-(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)エストラ-1,3,5(10),16-テトラエン
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： C30H47BO3Si
Molecular formula furigana： C30-H47-B-O3-SI
Molecular weight： 494.600
InChI： InChI=1S/C30H47BO3Si/c1-27(2,3)35(9,10)32-21-12-14-22-20(19-21)11-13-24-23(22)17-18-30(8)25(24)15-16-26(30)31-33-28(4,5)29(6,7)34-31/h12,14,16,19,23-25H,11,13,15,17-18H2,1-10H3/t23-,24-,25+,30+/m1/s1
InChI key： MWIVXAGAJOQIHD-ZRIOWSNCSA-N
SMILES： CC(C)(C)[Si](C)(C)Oc1ccc2[C@H]3CC[C@@]4(C)[C@@H](CC=C4B4OC(C)(C)C(C)(C)O4)[C@@H]3CCc2c1
Systematic name  (3)：
  • 3-(tert-ブチルジメチルシロキシ)-17-(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)エストラ-1,3,5(10),16-テトラエン
  • {[(3aS,3bS,9bS,11aS)-11a-メチル-1-(4,4,5,5-テトラメチル-1,3,2-ジオキサボロラン-2-イル)-3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-イル]オキシ}(tert-ブチル)ジメチルシラン
  • {[(3aS,3bS,9bS,11aS)-11a-methyl-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3H,3aH,3bH,4H,5H,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl]oxy}(tert-butyl)dimethylsilane
Other name (1)：
  • 3-(tert-Butyldimethylsiloxy)-17-(4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl)estra-1,3,5(10),16-tetrene
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