Chem
J-GLOBAL ID:200907056321626349   Nikkaji number:J1.706.233F

3-[(E)-2-[(1S)-4α-Hydroxy-2,2,6α-trimethyl-7-oxabicyclo[4.1.0]heptane-1α-yl]ethenyl]-5-[(1Z,2E)-2-methyl-4-oxo-2-butenylidene]furan-2(5H)-one

3-[(E)-2-[(1S)-4α-ヒドロキシ-2,2,6α-トリメチル-7-オキサビシクロ[4.1.0]ヘプタン-1α-イル]エテニル]-5-[(1Z,2E)-2-メチル-4-オキソ-2-ブテニリデン]フラン-2(5H)-オン
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: C20H24O5
Molecular formula furigana: C20-H24-O5
Molecular weight: 344.407
InChI: InChI=1S/C20H24O5/c1-13(6-8-21)9-16-10-14(17(23)24-16)5-7-20-18(2,3)11-15(22)12-19(20,4)25-20/h5-10,15,22H,11-12H2,1-4H3/b7-5+,13-6+,16-9-/t15-,19+,20-/m0/s1
InChI key: ZAPMDQSNZKWNRR-SZZQWQMASA-N
SMILES: C/C(=C\C=O)/C=C/1\OC(=O)C(=C1)/C=C/[C@@]12O[C@]1(C)C[C@@H](O)CC2(C)C
Systematic name  (4):
  • (E)-3-メチル-4-[[(2Z)-4-[(E)-2-[(1S,4S,6R)-2,2,6-トリメチル-4-ヒドロキシ-7-オキサビシクロ[4.1.0]ヘプタン-1-イル]エテニル]-5-オキソ-2,5-ジヒドロフラン]-2-イリデン]-2-ブテナール
  • 3-[(E)-2-[(1S)-4α-ヒドロキシ-2,2,6α-トリメチル-7-オキサビシクロ[4.1.0]ヘプタン-1α-イル]エテニル]-5-[(1Z,2E)-2-メチル-4-オキソ-2-ブテニリデン]フラン-2(5H)-オン
  • (2E)-4-[(2Z)-4-[(1E)-2-[(1S,4S,6R)-4-ヒドロキシ-2,2,6-トリメチル-7-オキサビシクロ[4.1.0]ヘプタン-1-イル]エテニル]-5-オキソ-2,5-ジヒドロフラン-2-イリデン]-3-メチルブタ-2-エナール
  • (2E)-4-[(2Z)-4-[(1E)-2-[(1S,4S,6R)-4-hydroxy-2,2,6-trimethyl-7-oxabicyclo[4.1.0]heptan-1-yl]ethenyl]-5-oxo-2,5-dihydrofuran-2-ylidene]-3-methylbut-2-enal
Other name (2):
  • (E)-3-Methyl-4-[[(2Z)-4-[(E)-2-[(1S,4S,6R)-2,2,6-trimethyl-4-hydroxy-7-oxabicyclo[4.1.0]heptane-1-yl]ethenyl]-5-oxo-2,5-dihydrofuran]-2-ylidene]-2-butenal
  • 3-[(E)-2-[(1S)-4α-Hydroxy-2,2,6α-trimethyl-7-oxabicyclo[4.1.0]heptane-1α-yl]ethenyl]-5-[(1Z,2E)-2-methyl-4-oxo-2-butenylidene]furan-2(5H)-one
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