Chem
J-GLOBAL ID：200907066440442480   Nikkaji number：J1.459.287C

1-(3,4-Dimethoxybenzyl)-6-oxo-7-methoxy-8a-acetoxy-1,2,3,4,6,8a-hexahydroisoquinoline-2-carbaldehyde

1-(3,4-ジメトキシベンジル)-6-オキソ-7-メトキシ-8a-アセトキシ-1,2,3,4,6,8a-ヘキサヒドロイソキノリン-2-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： C22H25NO7
Molecular formula furigana： C22-H25-N-O7
Molecular weight： 415.442
InChI： InChI=1S/C22H25NO7/c1-14(25)30-22-12-20(29-4)17(26)11-16(22)7-8-23(13-24)21(22)10-15-5-6-18(27-2)19(9-15)28-3/h5-6,9,11-13,21H,7-8,10H2,1-4H3
InChI key： NKCIQYRKIGGJPF-UHFFFAOYSA-N
SMILES： COC1=CC2(OC(=O)C)C(Cc3ccc(OC)c(OC)c3)N(CCC2=CC1=O)C=O
Systematic name  (3)：
  • 1-(3,4-ジメトキシベンジル)-6-オキソ-7-メトキシ-8a-アセトキシ-1,2,3,4,6,8a-ヘキサヒドロイソキノリン-2-カルボアルデヒド
  • 1-[(3,4-ジメトキシフェニル)メチル]-2-ホルミル-7-メトキシ-6-オキソ-1,2,3,4,6,8a-ヘキサヒドロイソキノリン-8a-イル アセタート
  • 1-[(3,4-dimethoxyphenyl)methyl]-2-formyl-7-methoxy-6-oxo-1,2,3,4,6,8a-hexahydroisoquinolin-8a-yl acetate
Other name (1)：
  • 1-(3,4-Dimethoxybenzyl)-6-oxo-7-methoxy-8a-acetoxy-1,2,3,4,6,8a-hexahydroisoquinoline-2-carbaldehyde
Thsaurus map：
Thesaurus Map

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