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Substance Name: Trigonelline hydrochloride
RN: 6138-41-6
UNII: 89A86B74I9
InChIKey: TZSYLWAXZMNUJB-UHFFFAOYSA-N

Note

  • In hydra among other organisms.

Molecular Formula

  • C7-H8-N-O2.Cl

Molecular Weight

  • 173.5982
 
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Names and Synonyms

Results Name

  • Trigonelline hydrochloride

Name of Substance

  • Trigonelline hydrochloride

Synonyms

  • EINECS 228-119-5
  • N-Methyl-3-carboxypyridinium chloride
  • N-Methylnicotinic acid chloride
  • NSC 66510
  • Trigonelline
  • Trigonelline hydrochloride
  • Trigonelline, chloride
  • UNII-89A86B74I9

Systematic Names

  • 3-Carboxy-1-methylpyridinium chloride
  • Pyridinium, 3-carboxy-1-methyl-, chloride (8CI)(9CI)

Registry Numbers

CAS Registry Number

  • 6138-41-6

FDA UNII

  • 89A86B74I9

Other Registry Number

  • 209064-35-7

Related Registry Number

  • 535-83-1 (Parent)

System Generated Number

  • 0006138416

Molecular Formulas

Molecular Formula

  • C7-H8-N-O2.Cl

Molecular Formula Fragments

  • C7-H8-N-O2
  • Cl
  • COMPONENT

Structure Descriptors

InChI

1S/C7H7NO2.ClH/c1-8-4-2-3-6(5-8)7(9)10;/h2-5H,1H3;1H

InChIKey

TZSYLWAXZMNUJB-UHFFFAOYSA-N

Smiles

[Cl-].C[n+]1cccc(c1)C(=O)O