Mid000020: Isonicotinic acid

  Metabolite Information

Name
Isonicotinic acid
IUPAC Name
pyridine-4-carboxylic acid
Molecular Formula
C6H5NO2
Molecular Weight
123.11
Exact Mass
123.0320284
SMILES
C1=CN=CC=C1C(=O)O
InChIKey
TWBYWOBDOCUKOW-UHFFFAOYSA-N
InChI
InChI=1S/C6H5NO2/c8-6(9)5-1-3-7-4-2-5/h1-4H,(H,8,9)
Other Databases Link
CAS:55-22-1
KEGG:C07446

  Structure

  2D Structure
  3D Conformer

  Classification 

(data sourced from ClassyFire)

Kingdom: Organic compounds
    Superclass: Organoheterocyclic compounds
        Class: Pyridines and derivatives
            Subclass: Pyridinecarboxylic acids and derivatives

  Species containing this metabolite

Arabidopsis thaliana Astragalus membranaceus Chimonanthus praecox Cucurbita moschata Dioscorea bulbifera
Helianthus annuus Hemerocallis fulva Houpoea officinalis Juncus setchuensis Lindera megaphylla
Medicago sativa Nerium oleander Ophiopogon bodinieri Oryza sativa Persicaria chinensis
Platycodon grandiflorus Prunus spinosa Rhynchosia volubilis Sagittaria trifolia Scutellaria barbata
Taxus wallichiana var. chinensis Triticum aestivum Zea mays

  Metabolite Spectrum Accession Label

ARA00139p AS00017n CPRA00094p HFUL00066p DBUL00066p HOFF00123p JEFF00050n LMEG00038p MZ0049n MZ0048p
MED00184p NOLE00069p OBOD00094p PLGRA00154p PCHI00230p CMOS00187p PSPI00087p RVOL00086p RE0029p STRI00103p
SBAR00133n SBAR00134n SBAR00203p SBAR00204p SBAR00206p SBAR00208p SBAR00210p SBAR00211p SBAR00212p SBAR00213p
HANN00065n TAX00128p TAX00129p WT0034p WT0035p