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CHEBI:84854 - 2-hydroxyheptadecanoic acid

ChEBI IDCHEBI:84854
ChEBI Name2-hydroxyheptadecanoic acid
Stars
DefinitionA 2-hydroxy fatty acid that is heptadecanoic acid (margaric acid) substituted by a hydroxy group at position 2.
Last Modified10 November 2017
Submitternamrata
DownloadsMolfile
FormulaC17H34O3
Net Charge0
Average Mass286.456
Monoisotopic Mass286.25079
SMILESCCCCCCCCCCCCCCCC(O)C(=O)O
InChIInChI=1S/C17H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(18)17(19)20/h16,18H,2-15H2,1H3,(H,19,20)
InChIKeyKUZABABLVHWUGR-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)
2-hydroxyheptadecanoic acid (CHEBI:84854) has functional parent heptadecanoic acid (CHEBI:32365)
2-hydroxyheptadecanoic acid (CHEBI:84854) is a 2-hydroxy fatty acid (CHEBI:10283)
Incoming Relation(s)
2-hydroxyheptadecanoyl-CoA (CHEBI:139022) has functional parent 2-hydroxyheptadecanoic acid (CHEBI:84854)
IUPAC Name 
2-hydroxyheptadecanoic acid
Synonym  Source
2-hydroxymargaric acidChEBI
Manual XrefsDatabases
LMFA01050052LIPID MAPS
Registry NumbersSources
Reaxys:1786816Reaxys
CAS:25022-78-0ChemIDplus
Citations