Chem
J-GLOBAL ID：200907005418375460   Nikkaji number：J1.051.682J

(3aR)-2-Methyl-4α-(2,4,5-trimethylbenzyl)-5β-hydroxy-2,3,3aβ,4,5,6-hexahydro-1H-benzo[de]isoquinoline-1,3-dione

(3aR)-2-メチル-4α-(2,4,5-トリメチルベンジル)-5β-ヒドロキシ-2,3,3aβ,4,5,6-ヘキサヒドロ-1H-ベンゾ[de]イソキノリン-1,3-ジオン
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： C23H25NO3
Molecular formula furigana： C23-H25-N-O3
Molecular weight： 363.457
InChI： InChI=1S/C23H25NO3/c1-12-8-14(3)16(9-13(12)2)10-18-19(25)11-15-6-5-7-17-20(15)21(18)23(27)24(4)22(17)26/h5-9,18-19,21,25H,10-11H2,1-4H3/t18-,19+,21-/m1/s1
InChI key： HGVZMJTYHAEGDR-SVFBPWRDSA-N
SMILES： CN1C(=O)[C@@H]2[C@H](Cc3cc(C)c(C)cc3C)[C@@H](O)Cc3cccc(C1=O)c23
Systematic name  (3)：
  • (3aR)-2-メチル-4α-(2,4,5-トリメチルベンジル)-5β-ヒドロキシ-2,3,3aβ,4,5,6-ヘキサヒドロ-1H-ベンゾ[de]イソキノリン-1,3-ジオン
  • (5R,6S,7S)-7-ヒドロキシ-3-メチル-6-[(2,4,5-トリメチルフェニル)メチル]-3-アザトリシクロ[7.3.1.05,13]トリデカ-1(13),9,11-トリエン-2,4-ジオン
  • (5R,6S,7S)-7-hydroxy-3-methyl-6-[(2,4,5-trimethylphenyl)methyl]-3-azatricyclo[7.3.1.05,13]trideca-1(13),9,11-triene-2,4-dione
Other name (1)：
  • (3aR)-2-Methyl-4α-(2,4,5-trimethylbenzyl)-5β-hydroxy-2,3,3aβ,4,5,6-hexahydro-1H-benzo[de]isoquinoline-1,3-dione
Thsaurus map：
Thesaurus Map

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