Chem
J-GLOBAL ID：201007050218474720   Nikkaji number：J2.791.801H

3-Methoxy-D-homoestra-1,3,5(10),8,14-pentaen-17aβ-ol

3-メトキシ-D-ホモエストラ-1,3,5(10),8,14-ペンタエン-17aβ-オール
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： C20H24O2
Molecular formula furigana： C20-H24-O2
Molecular weight： 296.410
InChI： InChI=1S/C20H24O2/c1-20-11-10-16-15-9-7-14(22-2)12-13(15)6-8-17(16)18(20)4-3-5-19(20)21/h4,7,9,12,19,21H,3,5-6,8,10-11H2,1-2H3/t19-,20-/m0/s1
InChI key： GCSVNNSSUFCOCR-PMACEKPBSA-N
SMILES： COc1ccc2C3=C(CCc2c1)C1=CCC[C@H](O)[C@@]1(C)CC3
Systematic name  (3)：
  • 3-メトキシ-D-ホモエストラ-1,3,5(10),8,14-ペンタエン-17aβ-オール
  • (1S,12aS)-8-メトキシ-12a-メチル-1,2,3,5,6,11,12,12a-オクタヒドロクリセン-1-オール
  • (1S,12aS)-8-methoxy-12a-methyl-1,2,3,5,6,11,12,12a-octahydrochrysen-1-ol
Other name (2)：
  • 3-Methoxy-D-homoestra-1,3,5(10),8,14-pentaene-17aβ-ol
  • 3-Methoxy-D-homoestra-1,3,5(10),8,14-pentaen-17aβ-ol
KEGG COMPOUND： C15063
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