EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:76934 - 3,12-dihydroxylauric acid

ChEBI IDCHEBI:76934
ChEBI Name3,12-dihydroxylauric acid
Stars
DefinitionA dihydroxy monocarboxylic acid that consists of lauric (dodecanoic) acid bearing two hydroxy substituents at positions 3 and 12.
Last Modified24 January 2023
SubmitterSteve
DownloadsMolfile
FormulaC12H24O4
Net Charge0
Average Mass232.320
Monoisotopic Mass232.16746
SMILESO=C(O)CC(O)CCCCCCCCCO
InChIInChI=1S/C12H24O4/c13-9-7-5-3-1-2-4-6-8-11(14)10-12(15)16/h11,13-14H,1-10H2,(H,15,16)
InChIKeyJGEFOCOPBYAGDE-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)
3,12-dihydroxylauric acid (CHEBI:76934) has functional parent dodecanoic acid (CHEBI:30805)
3,12-dihydroxylauric acid (CHEBI:76934) is a 3-hydroxy fatty acid (CHEBI:59845)
3,12-dihydroxylauric acid (CHEBI:76934) is a dihydroxy monocarboxylic acid (CHEBI:35972)
3,12-dihydroxylauric acid (CHEBI:76934) is a ω-hydroxy-medium-chain fatty acid (CHEBI:194303)
3,12-dihydroxylauric acid (CHEBI:76934) is conjugate acid of 3,12-dihydroxylaurate (CHEBI:76618)
Incoming Relation(s)
3,12-dihydroxylaurate (CHEBI:76618) is conjugate base of 3,12-dihydroxylauric acid (CHEBI:76934)
IUPAC Name 
3,12-dihydroxydodecanoic acid
Synonyms  Source
β,ω-dihydroxylauric acidChEBI
β,ω-dihydroxydodecanoic acidChEBI