Chem
J-GLOBAL ID：200907085628405161   Nikkaji number：J718.762I

Benzoic acid 3aα,9bα-epoxy-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[a]naphthalene-1β-yl ester

安息香酸3aα,9bα-エポキシ-2,3,3a,4,5,9b-ヘキサヒドロ-1H-シクロペンタ[a]ナフタレン-1β-イル
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： C20H18O3
Molecular formula furigana： C20-H18-O3
Molecular weight： 306.361
InChI： InChI=1S/C20H18O3/c21-18(15-7-2-1-3-8-15)22-17-11-13-19-12-10-14-6-4-5-9-16(14)20(17,19)23-19/h1-9,17H,10-13H2/t17-,19-,20+/m0/s1
InChI key： KQOGTJSZVVGDHA-YSIASYRMSA-N
SMILES： O=C(O[C@H]1CC[C@@]23CCc4ccccc4[C@@]12O3)c1ccccc1
Systematic name  (5)：
  • 安息香酸[(1S)-2,3,4,5-テトラヒドロ-3aα,9bα-エポキシ-1H-シクロペンタ[a]ナフタレン]-1β-イル
  • 安息香酸3aα,9bα-エポキシ-2,3,3a,4,5,9b-ヘキサヒドロ-1H-シクロペンタ[a]ナフタレン-1β-イル
  • 安息香酸(1S)-3aα,9bα-エポキシ-2,3,3a,4,5,9b-ヘキサヒドロ-1H-シクロペンタ[a]ナフタレン-1β-イル
  • (1R,10S,13S)-14-オキサテトラシクロ[8.3.1.01,10.02,7]テトラデカ-2,4,6-トリエン-13-イル ベンゾアート
  • (1R,10S,13S)-14-oxatetracyclo[8.3.1.01,10.02,7]tetradeca-2,4,6-trien-13-yl benzoate
Other name (3)：
  • Benzoic acid [(1S)-2,3,4,5-tetrahydro-3aα,9bα-epoxy-1H-cyclopenta[a]naphthalen]-1β-yl ester
  • Benzoic acid 3aα,9bα-epoxy-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[a]naphthalene-1β-yl ester
  • Benzoic acid (1S)-3aα,9bα-epoxy-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[a]naphthalene-1β-yl ester
Thsaurus map：
Thesaurus Map

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