Chem
J-GLOBAL ID：200907034141855737   Nikkaji number：J2.743.779F

3β-(β-D-Glucopyranosyloxy)hexadecahydro-1H-cyclopenta[a]phenanthrene

3β-(β-D-グルコピラノシルオキシ)ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン
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： C23H38O6
Molecular formula furigana： C23-H38-O6
Molecular weight： 410.551
InChI： InChI=1S/C23H38O6/c24-11-19-20(25)21(26)22(27)23(29-19)28-14-6-9-16-13(10-14)5-8-17-15-3-1-2-12(15)4-7-18(16)17/h12-27H,1-11H2/t12?,13?,14-,15?,16?,17?,18?,19+,20+,21-,22+,23+/m0/s1
InChI key： XJOFOZUEVJESOR-BOKRIMDLSA-N
SMILES： OC[C@H]1O[C@@H](O[C@H]2CCC3C(CCC4C5CCCC5CCC34)C2)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • 3β-(β-D-グルコピラノシルオキシ)ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン
  • (2R,3R,4S,5S,6R)-2-[(7S)-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-7-イルオキシ]-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
  • (2R,3R,4S,5S,6R)-2-[(7S)-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yloxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1)：
  • 3β-(β-D-Glucopyranosyloxy)hexadecahydro-1H-cyclopenta[a]phenanthrene
KEGG COMPOUND： C03641
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