Chem
J-GLOBAL ID:200907091755357109   Nikkaji number:J1.954.791D

(2β,8α)-3-Oxo-7β-methyltricyclo[6.4.0.02,7]dodecane-1α-carboxylic acid methyl ester

(2β,8α)-3-オキソ-7β-メチルトリシクロ[6.4.0.02,7]ドデカン-1α-カルボン酸メチル
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: C15H22O3
Molecular formula furigana: C15-H22-O3
Molecular weight: 250.338
InChI: InChI=1S/C15H22O3/c1-14-8-5-6-10(16)12(14)15(13(17)18-2)9-4-3-7-11(14)15/h11-12H,3-9H2,1-2H3/t11-,12-,14-,15+/m1/s1
InChI key: IKPHCIYOJAHBHF-GBOPCIDUSA-N
SMILES: COC(=O)[C@@]12CCCC[C@@H]1[C@@]1(C)CCCC(=O)[C@@H]21
Systematic name  (3):
  • (2β,8α)-3-オキソ-7β-メチルトリシクロ[6.4.0.02,7]ドデカン-1α-カルボン酸メチル
  • メチル (4aS,4bR,8aR,8bR)-8a-メチル-5-オキソ-ドデカヒドロビフェニレン-4a-カルボキシラート
  • methyl (4aS,4bR,8aR,8bR)-8a-methyl-5-oxo-dodecahydrobiphenylene-4a-carboxylate
Other name (1):
  • (2β,8α)-3-Oxo-7β-methyltricyclo[6.4.0.02,7]dodecane-1α-carboxylic acid methyl ester
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