Chem
J-GLOBAL ID:200907016418352900   Nikkaji number:J2.119.208B

(2β,9E)-5α-Acetoxy-6α-methyl-13α-hydroxytricyclo[13.2.2.2,6]nonadecane-1(17),9,15,18-tetrene-17-carbaldehyde

(2β,9E)-5α-アセトキシ-6α-メチル-13α-ヒドロキシトリシクロ[13.2.2.2,6]ノナデカン-1(17),9,15,18-テトラエン-17-カルボアルデヒド
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: C23H30O4
Molecular formula furigana: C23-H30-O4
Molecular weight: 370.489
InChI: InChI=1S/C23H30O4/c1-16(25)27-22-11-10-21-20-9-8-17(13-18(20)15-24)14-19(26)7-5-3-4-6-12-23(21,22)2/h3-4,8-9,13,15,19,21-22,26H,5-7,10-12,14H2,1-2H3/b4-3-/t19-,21-,22-,23-/m0/s1
InChI key: LAQXXDZJJOPZJX-VZXMJTDNSA-N
SMILES: CC(=O)O[C@H]1CC[C@H]2c3ccc(C[C@@H](O)CC/C=C\CC[C@]12C)cc3C=O
Systematic name  (3):
  • (2β,9E)-5α-アセトキシ-6α-メチル-13α-ヒドロキシトリシクロ[13.2.2.2,6]ノナデカン-1(17),9,15,18-テトラエン-17-カルボアルデヒド
  • (2S,5S,6S,9Z,13S)-18-ホルミル-13-ヒドロキシ-6-メチルトリシクロ[13.2.2.02,6]ノナデカ-1(17),9,15,18-テトラエン-5-イル アセタート
  • (2S,5S,6S,9Z,13S)-18-formyl-13-hydroxy-6-methyltricyclo[13.2.2.02,6]nonadeca-1(17),9,15,18-tetraen-5-yl acetate
Other name (1):
  • (2β,9E)-5α-Acetoxy-6α-methyl-13α-hydroxytricyclo[13.2.2.2,6]nonadecane-1(17),9,15,18-tetrene-17-carbaldehyde
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