Chem
J-GLOBAL ID：201107048093677359   Nikkaji number：J2.946.941E

9,10α-Dimethyl-8α,17β-bis(methoxymethoxy)-3,3-(ethylenedioxy)estrane-11-ene

9,10α-ジメチル-8α,17β-ビス(メトキシメトキシ)-3,3-(エチレンジオキシ)エストラン-11-エン
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： C26H42O6
Molecular formula furigana： C26-H42-O6
Molecular weight： 450.616
InChI： InChI=1S/C26H42O6/c1-22-10-12-24(3)23(2)11-13-25(30-14-15-31-25)16-19(23)8-9-26(24,32-18-28-5)20(22)6-7-21(22)29-17-27-4/h10,12,19-21H,6-9,11,13-18H2,1-5H3/t19?,20-,21+,22+,23-,24-,26+/m1/s1
InChI key： NEQFGFNIWTWZAU-AAHYXTSSSA-N
SMILES： COCO[C@H]1CC[C@@H]2[C@]1(C)C=C[C@]1(C)[C@]3(C)CCC4(CC3CC[C@]21OCOC)OCCO4
Systematic name  (3)：
  • 9,10α-ジメチル-8α,17β-ビス(メトキシメトキシ)-3,3-(エチレンジオキシ)エストラン-11-エン
  • (1S,3aR,3bS,9aR,9bR,11aS)-1,3b-ビス(メトキシメトキシ)-9a,9b,11a-トリメチル-1,2,3,3a,3b,4,5,5a,6,8,9,9a,9b,11a-テトラデカヒドロスピロ[シクロペンタ[a]フェナントレン-7,2'-[1,3]ジオキソラン]
  • (1S,3aR,3bS,9aR,9bR,11aS)-1,3b-bis(methoxymethoxy)-9a,9b,11a-trimethyl-1,2,3,3a,3b,4,5,5a,6,8,9,9a,9b,11a-tetradecahydrospiro[cyclopenta[a]phenanthrene-7,2'-[1,3]dioxolane]
Other name (1)：
  • 9,10α-Dimethyl-8α,17β-bis(methoxymethoxy)-3,3-(ethylenedioxy)estrane-11-ene
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