Chem
J-GLOBAL ID：200907019679211083   Nikkaji number：J1.625.885G

Benzoic acid (1R,4aα,12aα)-1α-(tert-butyldiphenylsiloxymethyl)-4α-isopropyl-6,10-dimethyl-9-oxo-10β-hydroxy-5β,12β-epoxytetradecahydrobenzocyclodecene-6α-yl ester

安息香酸(1R,4aα,12aα)-1α-(tert-ブチルジフェニルシロキシメチル)-4α-イソプロピル-6,10-ジメチル-9-オキソ-10β-ヒドロキシ-5β,12β-エポキシテトラデカヒドロベンゾシクロデセン-6α-イル
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： C43H56O6Si
Molecular formula furigana： C43-H56-O6-SI
Molecular weight： 697.000
InChI： InChI=1S/C43H56O6Si/c1-29(2)34-24-23-31(28-47-50(41(3,4)5,32-19-13-9-14-20-32)33-21-15-10-16-22-33)37-35-27-42(6,46)36(44)25-26-43(7,39(48-35)38(34)37)49-40(45)30-17-11-8-12-18-30/h8-22,29,31,34-35,37-39,46H,23-28H2,1-7H3/t31-,34+,35+,37+,38+,39+,42-,43+/m0/s1
InChI key： NDUONUYAUGFOPY-OHBGHNRWSA-N
SMILES： CC(C)[C@H]1CC[C@@H](CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)[C@@H]2[C@H]3C[C@](C)(O)C(=O)CC[C@@](C)(OC(=O)c4ccccc4)[C@H](O3)[C@H]12
Systematic name  (3)：
  • 安息香酸(1R,4aα,12aα)-1α-(tert-ブチルジフェニルシロキシメチル)-4α-イソプロピル-6,10-ジメチル-9-オキソ-10β-ヒドロキシ-5β,12β-エポキシテトラデカヒドロベンゾシクロデセン-6α-イル
  • (1R,2S,3R,6R,7R,8R,9R,13S)-3-{[(tert-ブチルジフェニルシリル)オキシ]メチル}-13-ヒドロキシ-9,13-ジメチル-12-オキソ-6-(プロパン-2-イル)-15-オキサトリシクロ[6.6.1.02,7]ペンタデカン-9-イル ベンゾアート
  • (1R,2S,3R,6R,7R,8R,9R,13S)-3-{[(tert-butyldiphenylsilyl)oxy]methyl}-13-hydroxy-9,13-dimethyl-12-oxo-6-(propan-2-yl)-15-oxatricyclo[6.6.1.02,7]pentadecan-9-yl benzoate
Other name (1)：
  • Benzoic acid (1R,4aα,12aα)-1α-(tert-butyldiphenylsiloxymethyl)-4α-isopropyl-6,10-dimethyl-9-oxo-10β-hydroxy-5β,12β-epoxytetradecahydrobenzocyclodecene-6α-yl ester
Thsaurus map：
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