Chem
J-GLOBAL ID：200907064337860972   Nikkaji number：J2.201.491I

(2E,4E,6S)-4-Methyl-6-(hydroxymethyl)-8-acetoxy-2,4-octadienoic acid (2R)-2α-[(1S,3R)-1,3-dimethyl-4-(2,3-dimethyloxiranyl)butyl]-6-oxo-3,6-dihydro-2H-pyran-3α-yl ester

(2E,4E,6S)-4-メチル-6-(ヒドロキシメチル)-8-アセトキシ-2,4-オクタジエン酸(2R)-2α-[(1S,3R)-1,3-ジメチル-4-(2,3-ジメチルオキシラニル)ブチル]-6-オキソ-3,6-ジヒドロ-2H-ピラン-3α-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： C27H40O8
Molecular formula furigana： C27-H40-O8
Molecular weight： 492.609
InChI： InChI=1S/C27H40O8/c1-17(14-22(16-28)11-12-32-21(5)29)7-9-24(30)33-23-8-10-25(31)34-26(23)19(3)13-18(2)15-27(6)20(4)35-27/h7-10,14,18-20,22-23,26,28H,11-13,15-16H2,1-6H3/b9-7+,17-14+/t18-,19+,20?,22+,23-,26-,27?/m1/s1
InChI key： BBWLZIBLLXJRRD-KGJZUQMFSA-N
SMILES： C[C@H](C[C@H](C)[C@H]1OC(=O)C=C[C@H]1OC(=O)/C=C/C(=C/[C@@H](CO)CCOC(=O)C)/C)CC1(C)OC1C
Systematic name  (3)：
  • (2E,4E,6S)-4-メチル-6-(ヒドロキシメチル)-8-アセトキシ-2,4-オクタジエン酸(2R)-2α-[(1S,3R)-1,3-ジメチル-4-(2,3-ジメチルオキシラニル)ブチル]-6-オキソ-3,6-ジヒドロ-2H-ピラン-3α-イル
  • (2R,3R)-2-[(2S,4R)-5-(2,3-ジメチルオキシラン-2-イル)-4-メチルペンタン-2-イル]-6-オキソ-3,6-ジヒドロ-2H-ピラン-3-イル (2E,4E,6S)-8-(アセチルオキシ)-6-(ヒドロキシメチル)-4-メチルオクタ-2,4-ジエノアート
  • (2R,3R)-2-[(2S,4R)-5-(2,3-dimethyloxiran-2-yl)-4-methylpentan-2-yl]-6-oxo-3,6-dihydro-2H-pyran-3-yl (2E,4E,6S)-8-(acetyloxy)-6-(hydroxymethyl)-4-methylocta-2,4-dienoate
Other name (1)：
  • (2E,4E,6S)-4-Methyl-6-(hydroxymethyl)-8-acetoxy-2,4-octadienoic acid (2R)-2α-[(1S,3R)-1,3-dimethyl-4-(2,3-dimethyloxiranyl)butyl]-6-oxo-3,6-dihydro-2H-pyran-3α-yl ester
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