Chem
J-GLOBAL ID：200907043466524779
Nikkaji number：J1.919.260A
(1β,7α,8β)-5,6,11,12-Tetraoxotricyclo[6.2.2.02,7]dodeca-3,9-diene-2α,9-diacrylic acid dimethyl ester
(1β,7α,8β)-5,6,11,12-テトラオキソトリシクロ[6.2.2.02,7]ドデカ-3,9-ジエン-2α,9-ジアクリル酸ジメチル
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： C20H16O8
Molecular formula furigana： C20-H16-O8
Molecular weight： 384.340
InChI：
InChI=1S/C20H16O8/c1-27-13(22)4-3-10-9-11-17(24)19(26)15(10)16-18(25)12(21)5-7-20(11,16)8-6-14(23)28-2/h3-9,11,15-16H,1-2H3/t11-,15-,16+,20-/m0/s1
InChI key：
HLVSYOCJLKKILZ-WJEOJLFVSA-N
SMILES：
COC(=O)C=CC1=C[C@H]2C(=O)C(=O)[C@@H]1[C@@H]1C(=O)C(=O)C=C[C@]21C=CC(=O)OC
Systematic name (3)：
- (1β,7α,8β)-5,6,11,12-テトラオキソトリシクロ[6.2.2.02,7]ドデカ-3,9-ジエン-2α,9-ジアクリル酸ジメチル
- メチル 3-[(1R,2S,7S,8R)-2-(3-メトキシ-3-オキソプロパ-1-エン-1-イル)-5,6,11,12-テトラオキソトリシクロ[6.2.2.02,7]ドデカ-3,9-ジエン-9-イル]プロパ-2-エノアート
- methyl 3-[(1R,2S,7S,8R)-2-(3-methoxy-3-oxoprop-1-en-1-yl)-5,6,11,12-tetraoxotricyclo[6.2.2.02,7]dodeca-3,9-dien-9-yl]prop-2-enoate
- (1β,7α,8β)-5,6,11,12-Tetraoxotricyclo[6.2.2.02,7]dodeca-3,9-diene-2α,9-diacrylic acid dimethyl ester
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