Chem
J-GLOBAL ID：201607007469329216   Nikkaji number：J3.466.087E

Methyl carlactonate

カルラクトン酸メチル
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： C20H28O5
Molecular formula furigana： C20-H28-O5
Molecular weight： 348.439
InChI： InChI=1S/C20H28O5/c1-8-20(5,6)16(13(2)3)10-9-15(19(22)23-7)12-24-17-11-14(4)18(21)25-17/h9-12,17H,8H2,1-7H3/b10-9+,15-12-
InChI key： GGVFHIIHZSMZDH-ADCBRGLKSA-N
SMILES： CCC(C)(C)C(=C(C)C)/C=C/C(=C/OC1OC(=O)C(=C1)C)/C(=O)OC
Systematic name  (4)：
  • (3E)-2-[(Z)-(4-メチル-5-オキソ-2,5-ジヒドロフラン-2-イルオキシ)メチレン]-5-(1,1-ジメチルプロピル)-6-メチル-3,5-ヘプテン酸メチル
  • (3E)-6,6-ジメチル-2-[(Z)-[(4-メチル-5(2H)-オキソフラン-2-イル)オキシ]メチレン]-5-(プロパン-2-イリデン)-3-オクテン酸メチル
  • メチル (2Z,3E)-6,6-ジメチル-2-{[(4-メチル-5-オキソ-2,5-ジヒドロフラン-2-イル)オキシ]メチリデン}-5-(プロパン-2-イリデン)オクタ-3-エノアート
  • methyl (2Z,3E)-6,6-dimethyl-2-{[(4-methyl-5-oxo-2,5-dihydrofuran-2-yl)oxy]methylidene}-5-(propan-2-ylidene)oct-3-enoate
Other name (4)：
  • (3E)-2-[(Z)-(4-Methyl-5-oxo-2,5-dihydrofuran-2-yloxy)methylene]-5-(1,1-dimethylpropyl)-6-methyl-3,5-heptenoic acid methyl ester
  • カルラクトン酸メチル
  • Methyl carlactonate
  • (3E)-6,6-Dimethyl-2-[(Z)-[(4-methyl-5(2H)-oxofuran-2-yl)oxy]methylene]-5-(propane-2-ylidene)-3-octenoic acid methyl ester
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