Chem
J-GLOBAL ID:200907048394743391   Nikkaji number:J1.917.007A

(2aβ,2bβ,4bβ)-1-(4-Methoxybenzyl)-2-oxooctahydrocyclopropa[cd]pentalene-4aβ-carboxylic acid methyl ester

(2aβ,2bβ,4bβ)-1-(4-メトキシベンジル)-2-オキソオクタヒドロシクロプロパ[cd]ペンタレン-4aβ-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: C18H20O4
Molecular formula furigana: C18-H20-O4
Molecular weight: 300.354
InChI: InChI=1S/C18H20O4/c1-21-11-5-3-10(4-6-11)9-13-16(19)14-12-7-8-18(13,15(12)14)17(20)22-2/h3-6,12-15H,7-9H2,1-2H3/t12-,13?,14+,15-,18-/m0/s1
InChI key: PVXZZYJIWGFVCX-CAMSNTMWSA-N
SMILES: COC(=O)[C@]12CC[C@H]3[C@H]([C@@H]13)C(=O)C2Cc1ccc(OC)cc1
Systematic name  (3):
  • (2aβ,2bβ,4bβ)-1-(4-メトキシベンジル)-2-オキソオクタヒドロシクロプロパ[cd]ペンタレン-4aβ-カルボン酸メチル
  • メチル (1S,2R,5R,8R)-4-[(4-メトキシフェニル)メチル]-3-オキソトリシクロ[3.3.0.02,8]オクタン-5-カルボキシラート
  • methyl (1S,2R,5R,8R)-4-[(4-methoxyphenyl)methyl]-3-oxotricyclo[3.3.0.02,8]octane-5-carboxylate
Other name (1):
  • (2aβ,2bβ,4bβ)-1-(4-Methoxybenzyl)-2-oxooctahydrocyclopropa[cd]pentalene-4aβ-carboxylic acid methyl ester
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