Chem
J-GLOBAL ID：200907066482199306   Nikkaji number：J1.830.242J

(2E,4S,5S,6E,8E)-4,8-Dimethyl-5-(tert-butyldimethylsiloxy)-10-[(2R,3S,6S,8S,9R)-3-methyl-8-[(1E,3E)-3-methyl-5-oxo-5-methoxy-1,3-pentadienyl]-9-butyl-9-hydroxy-1,7-dioxaspiro[5.5]undecane-2-yl]-2,6,8-decatrienoic acid methyl ester

(2E,4S,5S,6E,8E)-4,8-ジメチル-5-(tert-ブチルジメチルシロキシ)-10-[(2R,3S,6S,8S,9R)-3-メチル-8-[(1E,3E)-3-メチル-5-オキソ-5-メトキシ-1,3-ペンタジエニル]-9-ブチル-9-ヒドロキシ-1,7-ジオキサスピロ[5.5]ウンデカン-2-イル]-2,6,8-デカトリエン酸メチル
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： C40H66O8Si
Molecular formula furigana： C40-H66-O8-SI
Molecular weight： 703.045
InChI： InChI=1S/C40H66O8Si/c1-13-14-24-39(43)26-27-40(47-35(39)21-17-30(3)28-37(42)45-10)25-23-32(5)33(46-40)19-15-29(2)16-20-34(31(4)18-22-36(41)44-9)48-49(11,12)38(6,7)8/h15-18,20-22,28,31-35,43H,13-14,19,23-27H2,1-12H3/b20-16+,21-17+,22-18+,29-15+,30-28+/t31-,32-,33+,34-,35-,39+,40-/m0/s1
InChI key： VNQUVORAYVOWEP-GLBDMTPRSA-N
SMILES： CCCC[C@@]1(O)CC[C@]2(CC[C@H](C)[C@@H](C/C=C(\C)/C=C/[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](C)/C=C/C(=O)OC)O2)O[C@H]1/C=C/C(=C/C(=O)OC)/C
Systematic name  (3)：
  • (2E,4S,5S,6E,8E)-4,8-ジメチル-5-(tert-ブチルジメチルシロキシ)-10-[(2R,3S,6S,8S,9R)-3-メチル-8-[(1E,3E)-3-メチル-5-オキソ-5-メトキシ-1,3-ペンタジエニル]-9-ブチル-9-ヒドロキシ-1,7-ジオキサスピロ[5.5]ウンデカン-2-イル]-2,6,8-デカトリエン酸メチル
  • メチル (2E,4S,5S,6E,8E)-10-[(2R,3S,6S,8S,9R)-9-ブチル-9-ヒドロキシ-8-[(1E,3E)-5-メトキシ-3-メチル-5-オキソペンタ-1,3-ジエン-1-イル]-3-メチル-1,7-ジオキサスピロ[5.5]ウンデカン-2-イル]-5-[(tert-ブチルジメチルシリル)オキシ]-4,8-ジメチルデカ-2,6,8-トリエノアート
  • methyl (2E,4S,5S,6E,8E)-10-[(2R,3S,6S,8S,9R)-9-butyl-9-hydroxy-8-[(1E,3E)-5-methoxy-3-methyl-5-oxopenta-1,3-dien-1-yl]-3-methyl-1,7-dioxaspiro[5.5]undecan-2-yl]-5-[(tert-butyldimethylsilyl)oxy]-4,8-dimethyldeca-2,6,8-trienoate
Other name (1)：
  • (2E,4S,5S,6E,8E)-4,8-Dimethyl-5-(tert-butyldimethylsiloxy)-10-[(2R,3S,6S,8S,9R)-3-methyl-8-[(1E,3E)-3-methyl-5-oxo-5-methoxy-1,3-pentadienyl]-9-butyl-9-hydroxy-1,7-dioxaspiro[5.5]undecane-2-yl]-2,6,8-decatrienoic acid methyl ester
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