Chem
J-GLOBAL ID：200907082817300924   Nikkaji number：J1.276.772B

(3aβ,6aβ)-4-[(3S)-3-Hydroxyoctylidene]-5α-(benzoyloxy)hexahydro-2H-cyclopenta[b]furan-2-one

(3aβ,6aβ)-4-[(3S)-3-ヒドロキシオクチリデン]-5α-(ベンゾイルオキシ)ヘキサヒドロ-2H-シクロペンタ[b]フラン-2-オン
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： C22H28O5
Molecular formula furigana： C22-H28-O5
Molecular weight： 372.461
InChI： InChI=1S/C22H28O5/c1-2-3-5-10-16(23)11-12-17-18-13-21(24)26-20(18)14-19(17)27-22(25)15-8-6-4-7-9-15/h4,6-9,12,16,18-20,23H,2-3,5,10-11,13-14H2,1H3/t16-,18+,19+,20-/m0/s1
InChI key： BANCTJNUNSWZMB-NBYUQASBSA-N
SMILES： CCCCC[C@H](O)CC=C1[C@@H](C[C@@H]2OC(=O)C[C@H]12)OC(=O)c1ccccc1
Systematic name  (3)：
  • (3aβ,6aβ)-4-[(3S)-3-ヒドロキシオクチリデン]-5α-(ベンゾイルオキシ)ヘキサヒドロ-2H-シクロペンタ[b]フラン-2-オン
  • (3aR,5R,6aS)-4-[(3S)-3-ヒドロキシオクチリデン]-2-オキソ-ヘキサヒドロ-2H-シクロペンタ[b]フラン-5-イル ベンゾアート
  • (3aR,5R,6aS)-4-[(3S)-3-hydroxyoctylidene]-2-oxo-hexahydro-2H-cyclopenta[b]furan-5-yl benzoate
Other name (1)：
  • (3aβ,6aβ)-4-[(3S)-3-Hydroxyoctylidene]-5α-(benzoyloxy)hexahydro-2H-cyclopenta[b]furan-2-one
Thsaurus map：
Thesaurus Map

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