Chem
J-GLOBAL ID:200907017094642248   Nikkaji number:J2.547.176H

(1α)-5,6-Dimethyl-8β-hydroxy-9-methylenebicyclo[3.3.1]nonane-2β-carboxylic acid lactone

(1α)-5,6-ジメチル-8β-ヒドロキシ-9-メチレンビシクロ[3.3.1]ノナン-2β-カルボン酸ラクトン
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: C13H18O2
Molecular formula furigana: C13-H18-O2
Molecular weight: 206.285
InChI: InChI=1S/C13H18O2/c1-7-6-10-11-8(2)13(7,3)5-4-9(11)12(14)15-10/h7,9-11H,2,4-6H2,1,3H3/t7?,9-,10+,11+,13?/m0/s1
InChI key: OOZWPBBSWQJQIU-MAZPBLIFSA-N
SMILES: CC1C[C@H]2OC(=O)[C@H]3CCC1(C)C(=C)[C@@H]23
Systematic name  (3):
  • (1α)-5,6-ジメチル-8β-ヒドロキシ-9-メチレンビシクロ[3.3.1]ノナン-2β-カルボン酸ラクトン
  • (4R,7S,8S)-1,2-ジメチル-9-メチリデン-5-オキサトリシクロ[5.2.2.04,8]ウンデカン-6-オン
  • (4R,7S,8S)-1,2-dimethyl-9-methylidene-5-oxatricyclo[5.2.2.04,8]undecan-6-one
Other name (1):
  • (1α)-5,6-Dimethyl-8β-hydroxy-9-methylenebicyclo[3.3.1]nonane-2β-carboxylic acid lactone
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