Chem
J-GLOBAL ID：200907047538152524   Nikkaji number：J39.015A

Caffeoylputrescine

カフェオイルプトレシン
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： C13H18N2O3
Molecular formula furigana： C13-H18-N2-O3
Molecular weight： 250.298
InChI： InChI=1S/C13H18N2O3/c14-7-1-2-8-15-13(18)6-4-10-3-5-11(16)12(17)9-10/h3-6,9,16-17H,1-2,7-8,14H2,(H,15,18)
InChI key： KTZNZCYTXQYEHT-UHFFFAOYSA-N
SMILES： NCCCCNC(=O)C=Cc1ccc(O)c(O)c1
Systematic name  (3)：
  • N-(4-アミノブチル)-3-(3,4-ジヒドロキシフェニル)プロペンアミド
  • N-(4-アミノブチル)-3-(3,4-ジヒドロキシフェニル)プロパ-2-エンアミド
  • N-(4-aminobutyl)-3-(3,4-dihydroxyphenyl)prop-2-enamide
Other name (3)：
  • カフェオイルプトレシン
  • Caffeoylputrescine
  • N-(4-Aminobutyl)-3-(3,4-dihydroxyphenyl)propenamide
CAS registry number： 29554-26-5
KEGG COMPOUND： C03002
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