Chem
J-GLOBAL ID：200907020256177472   Nikkaji number：J1.614.091K

(E)-2-Methyl-2-butenoic acid 2-[1-hydroxy-1-(hydroxymethyl)-2-acetoxyethyl]-5-methylphenyl ester

(E)-2-メチル-2-ブテン酸2-[1-ヒドロキシ-1-(ヒドロキシメチル)-2-アセトキシエチル]-5-メチルフェニル
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： C17H22O6
Molecular formula furigana： C17-H22-O6
Molecular weight： 322.357
InChI： InChI=1S/C17H22O6/c1-5-12(3)16(20)23-15-8-11(2)6-7-14(15)17(21,9-18)10-22-13(4)19/h5-8,18,21H,9-10H2,1-4H3/b12-5+
InChI key： OYLDHSDJNYLZNV-LFYBBSHMSA-N
SMILES： C/C=C(\C)/C(=O)Oc1cc(C)ccc1C(O)(CO)COC(=O)C
Systematic name  (3)：
  • (E)-2-メチル-2-ブテン酸2-[1-ヒドロキシ-1-(ヒドロキシメチル)-2-アセトキシエチル]-5-メチルフェニル
  • 2-[1-(アセチルオキシ)-2,3-ジヒドロキシプロパン-2-イル]-5-メチルフェニル (2E)-2-メチルブタ-2-エノアート
  • 2-[1-(acetyloxy)-2,3-dihydroxypropan-2-yl]-5-methylphenyl (2E)-2-methylbut-2-enoate
Other name (1)：
  • (E)-2-Methyl-2-butenoic acid 2-[1-hydroxy-1-(hydroxymethyl)-2-acetoxyethyl]-5-methylphenyl ester
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