CHEBI:63891 - 3-oxopristanic acid

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ChEBI Name 3-oxopristanic acid
ChEBI ID CHEBI:63891
Definition A 3-oxo monocarboxylic acid comprised of pristanic acid with an oxo group at C-3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C19H36O3
Net Charge 0
Average Mass 312.48730
Monoisotopic Mass 312.26645
InChI InChI=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)
InChIKey MVYSUTIAAQDMGB-UHFFFAOYSA-N
SMILES CC(C)CCCC(C)CCCC(C)CCC(=O)C(C)C(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing 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 3-oxopristanoyl-CoA (CHEBI:15371) has functional parent 3-oxopristanic acid (CHEBI:63891)
IUPAC Name
2,6,10,14-tetramethyl-3-oxopentadecanoic acid
Last Modified
06 February 2017