Chem
J-GLOBAL ID：200907005004951176
Nikkaji number：J825.664K
(αE,1β,6β)-3,7α-Dimethoxy-4β-(methoxycarbonyl)-4-methylbicyclo[4.1.0]hept-2-ene-7-propenoic acid ethyl ester
(αE,1β,6β)-3,7α-ジメトキシ-4β-(メトキシカルボニル)-4-メチルビシクロ[4.1.0]ヘプタ-2-エン-7-プロペン酸エチル
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
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
Molecular formula： C17H24O6
Molecular formula furigana： C17-H24-O6
Molecular weight： 324.373
InChI：
InChI=1S/C17H24O6/c1-6-23-14(18)7-8-17(22-5)11-9-13(20-3)16(2,10-12(11)17)15(19)21-4/h7-9,11-12H,6,10H2,1-5H3/b8-7+/t11-,12+,16+,17-/m1/s1
InChI key：
GYAGPKXXVIOAGJ-RXAPPNLMSA-N
SMILES：
CCOC(=O)/C=C/[C@]1(OC)[C@H]2C[C@](C)(C(=O)OC)C(=C[C@@H]12)OC
Systematic name (3)：
- (αE,1β,6β)-3,7α-ジメトキシ-4β-(メトキシカルボニル)-4-メチルビシクロ[4.1.0]ヘプタ-2-エン-7-プロペン酸エチル
- メチル (1S,3S,6R,7S)-7-[(1E)-3-エトキシ-3-オキソプロパ-1-エン-1-イル]-4,7-ジメトキシ-3-メチルビシクロ[4.1.0]ヘプタ-4-エン-3-カルボキシラート
- methyl (1S,3S,6R,7S)-7-[(1E)-3-ethoxy-3-oxoprop-1-en-1-yl]-4,7-dimethoxy-3-methylbicyclo[4.1.0]hept-4-ene-3-carboxylate
- (αE,1β,6β)-3,7α-Dimethoxy-4β-(methoxycarbonyl)-4-methylbicyclo[4.1.0]hept-2-ene-7-propenoic acid ethyl ester
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