Chem
J-GLOBAL ID：200907072181981017   Nikkaji number：J2.622.071H

(6S)-6-Methyloctanoic acid (1S,3R)-3-[(Z)-2-(tributylstannyl)ethenyl]cyclohexyl ester

(6S)-6-メチルオクタン酸(1S,3R)-3-[(Z)-2-(トリブチルスタンニル)エテニル]シクロヘキシル
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： C29H56O2Sn
Molecular formula furigana： C29-H56-O2-SN
Molecular weight： 555.475
InChI： InChI=1S/C17H29O2.3C4H9.Sn/c1-4-14(3)9-6-7-12-17(18)19-16-11-8-10-15(5-2)13-16;3*1-3-4-2;/h2,5,14-16H,4,6-13H2,1,3H3;3*1,3-4H2,2H3;/t14-,15+,16-;;;;/m0..../s1
InChI key： SMFBTTUZKKNYMI-AEVDTWQXSA-N
SMILES： CCCC[Sn](CCCC)(CCCC)/C=C\[C@@H]1CCC[C@@H](C1)OC(=O)CCCC[C@@H](C)CC
Systematic name  (3)：
  • (6S)-6-メチルオクタン酸(1S,3R)-3-[(Z)-2-(トリブチルスタンニル)エテニル]シクロヘキシル
  • (1S,3R)-3-[(1Z)-2-(トリブチルスタンニル)エテニル]シクロヘキシル (6S)-6-メチルオクタノアート
  • (1S,3R)-3-[(1Z)-2-(tributylstannyl)ethenyl]cyclohexyl (6S)-6-methyloctanoate
Other name (1)：
  • (6S)-6-Methyloctanoic acid (1S,3R)-3-[(Z)-2-(tributylstannyl)ethenyl]cyclohexyl ester
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