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CHEBI:63900 - 3,16-dihydroxyhexadecanoic acid

ChEBI IDCHEBI:63900
ChEBI Name3,16-dihydroxyhexadecanoic acid
Stars
DefinitionA dihydroxy monocarboxylic acid that consists of palmitic acid bearing two hydroxy substituents at positions 3 and 16.
Last Modified24 September 2019
SubmitterSteve
DownloadsMolfile
FormulaC16H32O4
Net Charge0
Average Mass288.428
Monoisotopic Mass288.23006
SMILESO=C(O)CC(O)CCCCCCCCCCCCCO
InChIInChI=1S/C16H32O4/c17-13-11-9-7-5-3-1-2-4-6-8-10-12-15(18)14-16(19)20/h15,17-18H,1-14H2,(H,19,20)
InChIKeyZGYXOTYZKRXDBF-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)
3,16-dihydroxyhexadecanoic acid (CHEBI:63900) has functional parent 16-hydroxyhexadecanoic acid (CHEBI:55328)
3,16-dihydroxyhexadecanoic acid (CHEBI:63900) is a 3-hydroxy fatty acid (CHEBI:59845)
3,16-dihydroxyhexadecanoic acid (CHEBI:63900) is a dihydroxy monocarboxylic acid (CHEBI:35972)
3,16-dihydroxyhexadecanoic acid (CHEBI:63900) is a ω-hydroxy-long-chain fatty acid (CHEBI:140997)
3,16-dihydroxyhexadecanoic acid (CHEBI:63900) is conjugate acid of 3,16-dihydroxyhexadecanoate (CHEBI:63904)
Incoming Relation(s)
(3R)-3,16-dihydroxyhexadecanoic acid (CHEBI:79287) is a 3,16-dihydroxyhexadecanoic acid (CHEBI:63900)
3,16-dihydroxyhexadecanoate (CHEBI:63904) is conjugate base of 3,16-dihydroxyhexadecanoic acid (CHEBI:63900)
IUPAC Name 
3,16-dihydroxyhexadecanoic acid
Synonym  Source
3,16-dihydroxypalmitic acidChEBI
Manual XrefsDatabases
LMFA01050487LIPID MAPS
Registry NumbersSources
Reaxys:20870964Reaxys