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CHEBI:2010 - 5-(2'-formylethyl)-4,6-dihydroxypicolinic acid

ChEBI IDCHEBI:2010
ChEBI Name5-(2'-formylethyl)-4,6-dihydroxypicolinic acid
Stars
DefinitionA pyridinemonocarboxylic acid that is 1,6-dihydropyridine-2-carboxylic acid substituted by a hydroxy group at position 4, a 2'-formylethyl group at position 5 and an oxo group at position 6 respectively.
Last Modified12 June 2015
DownloadsMolfile
FormulaC9H9NO5
Net Charge0
Average Mass211.173
Monoisotopic Mass211.04807
SMILESO=CCCc1c(O)cc(C(=O)O)nc1=O
InChIInChI=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)
InChIKeyKJVDAGWOPCLJNY-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
5-(2'-formylethyl)-4,6-dihydroxypicolinic acid (CHEBI:2010) has functional parent picolinic acid (CHEBI:28747)
5-(2'-formylethyl)-4,6-dihydroxypicolinic acid (CHEBI:2010) is a aldehyde (CHEBI:17478)
5-(2'-formylethyl)-4,6-dihydroxypicolinic acid (CHEBI:2010) is a dioxo monocarboxylic acid (CHEBI:35951)
5-(2'-formylethyl)-4,6-dihydroxypicolinic acid (CHEBI:2010) is a hydroxy monocarboxylic acid (CHEBI:35868)
5-(2'-formylethyl)-4,6-dihydroxypicolinic acid (CHEBI:2010) is a pyridinemonocarboxylic acid (CHEBI:26420)
5-(2'-formylethyl)-4,6-dihydroxypicolinic acid (CHEBI:2010) is conjugate acid of 5-(2'-formylethyl)-4,6-dihydroxypicolinate (CHEBI:86003)
Incoming Relation(s)
5-(2'-formylethyl)-4,6-dihydroxypicolinate (CHEBI:86003) is conjugate base of 5-(2'-formylethyl)-4,6-dihydroxypicolinic acid (CHEBI:2010)
IUPAC Name 
4-hydroxy-6-oxo-5-(3-oxopropyl)-1,6-dihydropyridine-2-carboxylic acid
Manual XrefsDatabases
C05654KEGG COMPOUND