Chem
J-GLOBAL ID：200907086108402344   Nikkaji number：J14.744C

Coryneine

コリネイン
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： C11H18[N+]O2
Molecular formula furigana： C11-H18-N-O2
Molecular weight： 196.269
InChI： InChI=1S/C11H17NO2/c1-12(2,3)7-6-9-4-5-10(13)11(14)8-9/h4-5,8H,6-7H2,1-3H3,(H-,13,14)/p+1
InChI key： VDTBORSEFUUDTP-UHFFFAOYSA-O
SMILES： C[N+](C)(C)CCc1ccc(O)c(O)c1
Systematic name  (3)：
  • トリメチル(3,4-ジヒドロキシフェネチル)アミニウム
  • [2-(3,4-ジヒドロキシフェニル)エチル]トリメチルアザニウム
  • [2-(3,4-dihydroxyphenyl)ethyl]trimethylazanium
Other name (3)：
  • コリネイン
  • Coryneine
  • Trimethyl(3,4-dihydroxyphenethyl)aminium
CAS registry number： 7224-66-0
KEGG COMPOUND： C17486
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