Chem
J-GLOBAL ID:200907097677274518   Nikkaji number:J1.268.394D

(3aS)-3a,4,5,7a,8,9,10,11bβ-Octahydro-3aα-butyl-2,2,4,4,7aα-pentamethylbenzo[3,4]cycloocta[1,2-d]-1,3-dioxole

(2S,6S,11R)-6-ブチル-4,4,7,7,11-ペンタメチル-3,5-ジオキサトリシクロ[9.4.0.02,6]ペンタデカ-1(15),9-ジエン
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: C22H36O2
Molecular formula furigana: C22-H36-O2
Molecular weight: 332.528
InChI: InChI=1S/C22H36O2/c1-7-8-16-22-18(23-20(4,5)24-22)17-12-9-10-14-21(17,6)15-11-13-19(22,2)3/h11-12,15,18H,7-10,13-14,16H2,1-6H3/t18-,21+,22+/m0/s1
InChI key: YKMJLZSTJFJCTG-VLCRHTCISA-N
SMILES: CCCC[C@@]12OC(C)(C)O[C@H]1C1=CCCC[C@]1(C)C=CCC2(C)C
Systematic name  (3):
  • (3aS)-3a,4,5,7a,8,9,10,11bβ-オクタヒドロ-3aα-ブチル-2,2,4,4,7aα-ペンタメチルベンゾ[3,4]シクロオクタ[1,2-d]-1,3-ジオキソール
  • (2S,6S,11R)-6-ブチル-4,4,7,7,11-ペンタメチル-3,5-ジオキサトリシクロ[9.4.0.02,6]ペンタデカ-1(15),9-ジエン
  • (2S,6S,11R)-6-butyl-4,4,7,7,11-pentamethyl-3,5-dioxatricyclo[9.4.0.02,6]pentadeca-1(15),9-diene
Other name (1):
  • (3aS)-3a,4,5,7a,8,9,10,11bβ-Octahydro-3aα-butyl-2,2,4,4,7aα-pentamethylbenzo[3,4]cycloocta[1,2-d]-1,3-dioxole
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