Chem
J-GLOBAL ID：200907092244828355   Nikkaji number：J2.285.615D

(1R,2S,6R)-2-(tert-Butyldimethylsilyloxy)-5-oxo-6-[(5S)-5-hydroxyhexyl]-3-cyclohexene-1-acetic acid θ-lactone

(1R,2S,6R)-2-(tert-ブチルジメチルシリルオキシ)-5-オキソ-6-[(5S)-5-ヒドロキシヘキシル]-3-シクロヘキセン-1-酢酸θ-ラクトン
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： C20H34O4Si
Molecular formula furigana： C20-H34-O4-SI
Molecular weight： 366.573
InChI： InChI=1S/C20H34O4Si/c1-14-9-7-8-10-15-16(13-19(22)23-14)18(12-11-17(15)21)24-25(5,6)20(2,3)4/h11-12,14-16,18H,7-10,13H2,1-6H3/t14-,15+,16+,18-/m0/s1
InChI key： RDXMPAHGVCECIU-LHHMISFZSA-N
SMILES： C[C@H]1CCCC[C@@H]2[C@@H](CC(=O)O1)[C@@H](O[Si](C)(C)C(C)(C)C)C=CC2=O
Systematic name  (4)：
  • (1R,2S,6R)-2-(tert-ブチルジメチルシリルオキシ)-5-オキソ-6-[(5S)-5-ヒドロキシヘキシル]-3-シクロヘキセン-1-酢酸θ-ラクトン
  • (4S)-4α-(tert-ブチルジメチルシリルオキシ)-8β-メチル-4,4aβ,5,6,8,9,10,11,12,12aα-デカヒドロ-1H-7-オキサベンゾシクロデセン-1,6-ジオン
  • (4S,8aR,12S,12aR)-12-[(tert-ブチルジメチルシリル)オキシ]-4-メチル-2,4,5,6,7,8,8a,9,12,12a-デカヒドロ-1H-3-ベンゾオキセシン-2,9-ジオン
  • (4S,8aR,12S,12aR)-12-[(tert-butyldimethylsilyl)oxy]-4-methyl-2,4,5,6,7,8,8a,9,12,12a-decahydro-1H-3-benzoxecine-2,9-dione
Other name (2)：
  • (1R,2S,6R)-2-(tert-Butyldimethylsilyloxy)-5-oxo-6-[(5S)-5-hydroxyhexyl]-3-cyclohexene-1-acetic acid θ-lactone
  • (4S)-4α-(tert-Butyldimethylsilyloxy)-8β-methyl-4,4aβ,5,6,8,9,10,11,12,12aα-decahydro-1H-7-oxabenzocyclodecene-1,6-dione
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