EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:70767 - 2-hydroxyoctanedioic acid

ChEBI IDCHEBI:70767
ChEBI Name2-hydroxyoctanedioic acid
Stars
DefinitionA 2-hydroxydicarboxylic acid that is the 2-hydroxy derivative of suberic acid.
Last Modified9 November 2012
Submittermwilliams
DownloadsMolfile
FormulaC8H14O5
Net Charge0
Average Mass190.195
Monoisotopic Mass190.08412
SMILESO=C(O)CCCCCC(O)C(=O)O
InChIInChI=1S/C8H14O5/c9-6(8(12)13)4-2-1-3-5-7(10)11/h6,9H,1-5H2,(H,10,11)(H,12,13)
InChIKeyDHNJFWLYLQPITF-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
2-hydroxyoctanedioic acid (CHEBI:70767) has functional parent suberic acid (CHEBI:9300)
2-hydroxyoctanedioic acid (CHEBI:70767) has role metabolite (CHEBI:25212)
2-hydroxyoctanedioic acid (CHEBI:70767) is a 2-hydroxydicarboxylic acid (CHEBI:50263)
IUPAC Name 
2-hydroxyoctanedioic acid
Registry NumbersSources
Reaxys:1780563Reaxys
Citations