Chem
J-GLOBAL ID：200907058735357130   Nikkaji number：J825.659D

(αE,1α,6α)-3,7β-Dimethoxy-4α-(1-methylethenyl)bicyclo[4.1.0]hept-2-ene-7-propenoic acid ethyl ester

(αE,1α,6α)-3,7β-ジメトキシ-4α-(1-メチルエテニル)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
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： C17H24O4
Molecular formula furigana： C17-H24-O4
Molecular weight： 292.375
InChI： InChI=1S/C17H24O4/c1-6-21-16(18)7-8-17(20-5)13-9-12(11(2)3)15(19-4)10-14(13)17/h7-8,10,12-14H,2,6,9H2,1,3-5H3/b8-7+/t12-,13+,14-,17+/m0/s1
InChI key： NSZCNBKEDPPQRN-LBIOWBLGSA-N
SMILES： CCOC(=O)/C=C/[C@@]1(OC)[C@@H]2C[C@@H](C(=C)C)C(=C[C@H]12)OC
Systematic name  (3)：
  • (αE,1α,6α)-3,7β-ジメトキシ-4α-(1-メチルエテニル)ビシクロ[4.1.0]ヘプタ-2-エン-7-プロペン酸エチル
  • エチル (2E)-3-[(1S,4S,6R,7R)-3,7-ジメトキシ-4-(プロパ-1-エン-2-イル)ビシクロ[4.1.0]ヘプタ-2-エン-7-イル]プロパ-2-エノアート
  • ethyl (2E)-3-[(1S,4S,6R,7R)-3,7-dimethoxy-4-(prop-1-en-2-yl)bicyclo[4.1.0]hept-2-en-7-yl]prop-2-enoate
Other name (1)：
  • (αE,1α,6α)-3,7β-Dimethoxy-4α-(1-methylethenyl)bicyclo[4.1.0]hept-2-ene-7-propenoic acid ethyl ester
Thsaurus map：
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