Chem
J-GLOBAL ID：202007007858266257   Nikkaji number：J3.748.407E

(3aR,4S,8S,9S,9bR)-8-(acetyloxy)-9-(hydroxymethyl)-9-methyl-3-methylidene-2,6-dioxo-octahydroazuleno[4,5-b]furan-4-yl 2-methylprop-2-enoate

(3aR,4S,8S,9S,9bR)-8-(アセチルオキシ)-9-(ヒドロキシメチル)-9-メチル-3-メチリデン-2,6-ジオキソ-オクタヒドロアズレノ[4,5-b]フラン-4-イル2-メチルプロパ-2-エノアート
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： C21H26O8
Molecular formula furigana： C21-H26-O8
Molecular weight： 406.431
InChI： InChI=1S/C21H26O8/c1-9(2)19(25)28-14-7-13(24)12-6-15(27-11(4)23)21(5,8-22)17(12)18-16(14)10(3)20(26)29-18/h12,14-18,22H,1,3,6-8H2,2,4-5H3/t12?,14-,15-,16+,17?,18-,21-/m0/s1
InChI key： UTTGBSBQTNIOTP-USEQEAGNSA-N
SMILES： C12[C@H]3OC(=O)C(=C)[C@@H]3[C@H](CC(=O)C1C[C@@H]([C@@]2(CO)C)OC(=O)C)OC(=O)C(=C)C
Systematic name  (3)：
  • (2R,6R,7S,12S,13S)-5-メチレン-7-[(2-メチルプロペノイル)オキシ]-12-アセトキシ-13-メチル-13-(ヒドロキシメチル)-3-オキサトリシクロ[8.3.0.02,6]トリデカン-4,9-ジオン
  • (3aR,4S,8S,9S,9bR)-8-(アセチルオキシ)-9-(ヒドロキシメチル)-9-メチル-3-メチリデン-2,6-ジオキソ-ドデカヒドロアズレノ[4,5-b]フラン-4-イル2-メチルプロパ-2-エノアート
  • (3aR,4S,8S,9S,9bR)-8-(acetyloxy)-9-(hydroxymethyl)-9-methyl-3-methylidene-2,6-dioxo-dodecahydroazuleno[4,5-b]furan-4-yl 2-methylprop-2-enoate
Other name (2)：
  • (3aR,4S,8S,9S,9bR)-8-(アセチルオキシ)-9-(ヒドロキシメチル)-9-メチル-3-メチリデン-2,6-ジオキソ-オクタヒドロアズレノ[4,5-b]フラン-4-イル2-メチルプロパ-2-エノアート
  • (3aR,4S,8S,9S,9bR)-8-(acetyloxy)-9-(hydroxymethyl)-9-methyl-3-methylidene-2,6-dioxo-octahydroazuleno[4,5-b]furan-4-yl 2-methylprop-2-enoate
Thsaurus map：
Thesaurus Map

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