Chem
J-GLOBAL ID：200907065831056791   Nikkaji number：J14.985C

Tetrahymanol

テトラヒマノール
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： C30H52O
Molecular formula furigana： C30-H52-O
Molecular weight： 428.745
InChI： InChI=1S/C30H52O/c1-25(2)15-9-16-27(5)20(25)12-18-29(7)22(27)10-11-23-28(6)17-14-24(31)26(3,4)21(28)13-19-30(23,29)8/h20-24,31H,9-19H2,1-8H3/t20-,21-,22+,23+,24-,27-,28-,29+,30+/m0/s1
InChI key： BFNSRKHIVITRJP-VJBYBJRLSA-N
SMILES： CC1(C)CCC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC[C@@H]2[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]12C
Systematic name  (3)：
  • 5α-ガンマセラン-3β-オール
  • (3S,4aR,6aR,6bR,8aS,12aS,12bR,14aR,14bR)-4,4,6a,6b,9,9,12a,14b-オクタメチル-ドコサヒドロピセン-3-オール
  • (3S,4aR,6aR,6bR,8aS,12aS,12bR,14aR,14bR)-4,4,6a,6b,9,9,12a,14b-octamethyl-docosahydropicen-3-ol
Other name (5)：
  • テトラヒマノール
  • Tetrahymanol
  • ワリキニオール
  • Wallichiniol
  • 5α-Gammaceran-3β-ol
CAS registry number： 2130-17-8
KEGG COMPOUND： C06083
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