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CHEBI:63891 - 3-oxopristanic acid

ChEBI IDCHEBI:63891
ChEBI Name3-oxopristanic acid
Stars
DefinitionA 3-oxo monocarboxylic acid comprised of pristanic acid with an oxo group at C-3.
Last Modified6 February 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC19H36O3
Net Charge0
Average Mass312.494
Monoisotopic Mass312.26645
SMILESCC(C)CCCC(C)CCCC(C)CCC(=O)C(C)C(=O)O
InChIInChI=1S/C19H36O3/c1-14(2)8-6-9-15(3)10-7-11-16(4)12-13-18(20)17(5)19(21)22/h14-17H,6-13H2,1-5H3,(H,21,22)
InChIKeyMVYSUTIAAQDMGB-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-oxopristanic acid (CHEBI:63891) is a 3-oxo fatty acid (CHEBI:134416)
3-oxopristanic acid (CHEBI:63891) is a long-chain fatty acid (CHEBI:15904)
3-oxopristanic acid (CHEBI:63891) is a methyl-branched fatty acid (CHEBI:62499)
Incoming Relation(s)
3-oxopristanoyl-CoA (CHEBI:15371) has functional parent 3-oxopristanic acid (CHEBI:63891)
IUPAC Name 
2,6,10,14-tetramethyl-3-oxopentadecanoic acid