Chem
J-GLOBAL ID：200907069486225670   Nikkaji number：J1.503.922A

(3aS,6E,8S,10E,12aS)-3-Isopropyl-6,10,12a-trimethyl-8-hydroxy-4,5,8,9,12,12a-hexahydrocyclopentacycloundecene-1(3aH)-one

(3aS,6E,8S,10E,12aS)-3-イソプロピル-6,10,12a-トリメチル-8-ヒドロキシ-4,5,8,9,12,12a-ヘキサヒドロシクロペンタシクロウンデセン-1(3aH)-オン
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： C20H30O2
Molecular formula furigana： C20-H30-O2
Molecular weight： 302.458
InChI： InChI=1S/C20H30O2/c1-13(2)17-12-19(22)20(5)9-8-15(4)11-16(21)10-14(3)6-7-18(17)20/h8,10,12-13,16,18,21H,6-7,9,11H2,1-5H3/b14-10+,15-8+/t16-,18+,20+/m1/s1
InChI key： HQCVRJOFBONDTQ-QQIQNAPQSA-N
SMILES： CC(C)C1=CC(=O)[C@@]2(C)C/C=C(\C)/C[C@H](O)/C=C(\C)/CC[C@@H]12
Systematic name  (3)：
  • (3aS,6E,8S,10E,12aS)-3-イソプロピル-6,10,12a-トリメチル-8-ヒドロキシ-4,5,8,9,12,12a-ヘキサヒドロシクロペンタシクロウンデセン-1(3aH)-オン
  • (3aS,8S,12aS)-8-ヒドロキシ-6,10,12a-トリメチル-3-(プロパン-2-イル)-1H,3aH,4H,5H,8H,9H,12H,12aH-シクロペンタ[11]アンヌレン-1-オン
  • (3aS,8S,12aS)-8-hydroxy-6,10,12a-trimethyl-3-(propan-2-yl)-1H,3aH,4H,5H,8H,9H,12H,12aH-cyclopenta[11]annulen-1-one
Other name (1)：
  • (3aS,6E,8S,10E,12aS)-3-Isopropyl-6,10,12a-trimethyl-8-hydroxy-4,5,8,9,12,12a-hexahydrocyclopentacycloundecene-1(3aH)-one
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