Chem
J-GLOBAL ID：200907092080102110   Nikkaji number：J832.598G

Hop-22(29)-en-28-ol

ホパ-22(29)-エン-28-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： C30H50O
Molecular formula furigana： C30-H50-O
Molecular weight： 426.729
InChI： InChI=1S/C30H50O/c1-20(2)21-11-18-30(19-31)22(21)12-16-29(7)25(30)10-9-24-27(5)15-8-14-26(3,4)23(27)13-17-28(24,29)6/h21-25,31H,1,8-19H2,2-7H3/t21-,22+,23+,24-,25+,27+,28-,29-,30-/m1/s1
InChI key： AVTGBULLOOYGRR-AYHBXSNGSA-N
SMILES： CC(=C)[C@H]1CC[C@@]2(CO)[C@H]1CC[C@]1(C)[C@@H]2CC[C@@H]2[C@@]3(C)CCCC(C)(C)[C@@H]3CC[C@@]12C
Systematic name  (3)：
  • ホパ-22(29)-エン-28-オール
  • [(3S,3aS,5aR,5bR,7aS,11aS,11bR,13aS,13bR)-5a,5b,8,8,11a-ペンタメチル-3-(プロパ-1-エン-2-イル)-イコサヒドロ-1H-シクロペンタ[a]クリセン-13b-イル]メタノール
  • [(3S,3aS,5aR,5bR,7aS,11aS,11bR,13aS,13bR)-5a,5b,8,8,11a-pentamethyl-3-(prop-1-en-2-yl)-icosahydro-1H-cyclopenta[a]chrysen-13b-yl]methanol
Other name (1)：
  • Hop-22(29)-en-28-ol
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