Chem
J-GLOBAL ID：200907004249878222   Nikkaji number：J1.479.452B

(2S)-6α-Hydroxy-4aβ,5,6,7,8aα,9,9aα,10a-octahydro-6,10aβ-dimethyl-2-phenyl-2H,4H-1,3,8,10-tetraoxaanthracene-7β-acetic acid ethyl ester

(2S)-6α-ヒドロキシ-4aβ,5,6,7,8aα,9,9aα,10a-オクタヒドロ-6,10aβ-ジメチル-2-フェニル-2H,4H-1,3,8,10-テトラオキサアントラセン-7β-酢酸エチル
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： C22H30O7
Molecular formula furigana： C22-H30-O7
Molecular weight： 406.475
InChI： InChI=1S/C22H30O7/c1-4-25-19(23)11-17-21(2,24)13-22(3)18(28-17)10-15-16(29-22)12-26-20(27-15)14-8-6-5-7-9-14/h5-9,15-18,20,24H,4,10-13H2,1-3H3/t15-,16+,17-,18+,20+,21+,22-/m1/s1
InChI key： AFAQTLWNOIHMJK-DNNXKHSDSA-N
SMILES： CCOC(=O)C[C@H]1O[C@H]2C[C@H]3O[C@H](OC[C@@H]3O[C@]2(C)C[C@]1(C)O)c1ccccc1
Systematic name  (3)：
  • (2S)-6α-ヒドロキシ-4aβ,5,6,7,8aα,9,9aα,10a-オクタヒドロ-6,10aβ-ジメチル-2-フェニル-2H,4H-1,3,8,10-テトラオキサアントラセン-7β-酢酸エチル
  • エチル 2-[(1R,3S,6S,8R,10S,12R,13S)-13-ヒドロキシ-1,13-ジメチル-6-フェニル-2,5,7,11-テトラオキサトリシクロ[8.4.0.03,8]テトラデカン-12-イル]アセタート
  • ethyl 2-[(1R,3S,6S,8R,10S,12R,13S)-13-hydroxy-1,13-dimethyl-6-phenyl-2,5,7,11-tetraoxatricyclo[8.4.0.03,8]tetradecan-12-yl]acetate
Other name (1)：
  • (2S)-6α-Hydroxy-4aβ,5,6,7,8aα,9,9aα,10a-octahydro-6,10aβ-dimethyl-2-phenyl-2H,4H-1,3,8,10-tetraoxaanthracene-7β-acetic acid ethyl ester
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