Chem
J-GLOBAL ID：200907083452004650   Nikkaji number：J1.431.489J

2-(3,4-Dihydroxyphenyl)-3-[6-(trimethylaminio)hexyloxy]-4H-1-benzopyran-4-one

2-(3,4-ジヒドロキシフェニル)-3-[6-(トリメチルアミニオ)ヘキシルオキシ]-4H-1-ベンゾピラン-4-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： C24H30[N+]O5
Molecular formula furigana： C24-H30-N-O5
Molecular weight： 412.505
InChI： InChI=1S/C24H29NO5/c1-25(2,3)14-8-4-5-9-15-29-24-22(28)18-10-6-7-11-21(18)30-23(24)17-12-13-19(26)20(27)16-17/h6-7,10-13,16H,4-5,8-9,14-15H2,1-3H3,(H-,26,27,28)/p+1
InChI key： FCZCIQAOZGGUKL-UHFFFAOYSA-O
SMILES： C[N+](C)(C)CCCCCCOc1c(oc2ccccc2c1=O)c1ccc(O)c(O)c1
Systematic name  (3)：
  • 2-(3,4-ジヒドロキシフェニル)-3-[6-(トリメチルアミニオ)ヘキシルオキシ]-4H-1-ベンゾピラン-4-オン
  • (6-{[2-(3,4-ジヒドロキシフェニル)-4-オキソ-4H-クロメン-3-イル]オキシ}ヘキシル)トリメチルアザニウム
  • (6-{[2-(3,4-dihydroxyphenyl)-4-oxo-4H-chromen-3-yl]oxy}hexyl)trimethylazanium
Other name (1)：
  • 2-(3,4-Dihydroxyphenyl)-3-[6-(trimethylaminio)hexyloxy]-4H-1-benzopyran-4-one
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