Chem
J-GLOBAL ID：200907080208458098   Nikkaji number：J1.443.906D

(3S,5R,6S,9R)-Megastigmane-3,9-diol

(3S,5R,6S,9R)-メガスチグマン-3,9-ジオール
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： C13H26O2
Molecular formula furigana： C13-H26-O2
Molecular weight： 214.349
InChI： InChI=1S/C13H26O2/c1-9-7-11(15)8-13(3,4)12(9)6-5-10(2)14/h9-12,14-15H,5-8H2,1-4H3/t9-,10-,11+,12+/m1/s1
InChI key： YLDOBTZIBQRAPU-WYUUTHIRSA-N
SMILES： C[C@@H](O)CC[C@H]1[C@H](C)C[C@H](O)CC1(C)C
Systematic name  (4)：
  • (1S,4S,5R)-4-[(R)-3-ヒドロキシブチル]-3,3,5-トリメチル-1-シクロヘキサオール
  • (1S)-3,3,5α-トリメチル-4β-[(R)-3-ヒドロキシブチル]シクロヘキサン-1α-オール
  • (1S,4S,5R)-4-[(3R)-3-ヒドロキシブチル]-3,3,5-トリメチルシクロヘキサン-1-オール
  • (1S,4S,5R)-4-[(3R)-3-hydroxybutyl]-3,3,5-trimethylcyclohexan-1-ol
Other name (4)：
  • (1S,4S,5R)-4-[(R)-3-Hydroxybutyl]-3,3,5-trimethyl-1-cyclohexaol
  • (3S,5R,6S,9R)-メガスチグマン-3,9-ジオール
  • (3S,5R,6S,9R)-Megastigmane-3,9-diol
  • (1S)-3,3,5α-Trimethyl-4β-[(R)-3-hydroxybutyl]cyclohexane-1α-ol
Thsaurus map：
Thesaurus Map

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