CHEBI:86003 - 5-(2'-formylethyl)-4,6-dihydroxypicolinate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 5-(2'-formylethyl)-4,6-dihydroxypicolinate
ChEBI ID CHEBI:86003
Definition A pyridinemonocarboxylate that is the conjugate base of 5-(2'-formylethyl)-4,6-dihydroxypicolinic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C9H8NO5
Net Charge -1
Average Mass 210.16410
Monoisotopic Mass 210.04080
InChI InChI=1S/C9H9NO5/c11-3-1-2-5-7(12)4-6(9(14)15)10-8(5)13/h3-4H,1-2H2,(H,14,15)(H2,10,12,13)/p-1
InChIKey KJVDAGWOPCLJNY-UHFFFAOYSA-M
SMILES Oc1cc([nH]c(=O)c1CCC=O)C([O-])=O
ChEBI Ontology
Outgoing 5-(2'-formylethyl)-4,6-dihydroxypicolinate (CHEBI:86003) is a pyridinemonocarboxylate (CHEBI:38181)
5-(2'-formylethyl)-4,6-dihydroxypicolinate (CHEBI:86003) is conjugate base of 5-(2'-formylethyl)-4,6-dihydroxypicolinic acid (CHEBI:2010)
Incoming 5-(2'-formylethyl)-4,6-dihydroxypicolinic acid (CHEBI:2010) is conjugate acid of 5-(2'-formylethyl)-4,6-dihydroxypicolinate (CHEBI:86003)
IUPAC Name
4-hydroxy-6-oxo-5-(3-oxopropyl)-1,6-dihydropyridine-2-carboxylate
Synonym Source
5-(beta-Formylethyl)-4,6-dihydroxypicolinate KEGG COMPOUND
Manual Xref Database
C05654 KEGG COMPOUND
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Last Modified
12 June 2015