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CHEBI:42394 - tricosanoic acid

ChEBI IDCHEBI:42394
ChEBI Nametricosanoic acid
Stars
DefinitionA very long-chain fatty acid that is tricosane in which one of the methyl groups has been oxidised to the corresponding carboxylic acid.
Secondary ChEBI IDsCHEBI:39419, CHEBI:42392
Last Modified18 May 2022
Submitterunwin305
DownloadsMolfile
FormulaC23H46O2
Net Charge0
Average Mass354.619
Monoisotopic Mass354.34978
SMILESCCCCCCCCCCCCCCCCCCCCCCC(=O)O
InChIInChI=1S/C23H46O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(24)25/h2-22H2,1H3,(H,24,25)
InChIKeyXEZVDURJDFGERA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Daphnia magna (ncbitaxon:35525) - Article (Mixtures of similarly acting compounds in Daphnia magna: From gene to metabolite and beyondTine Vandenbrouck, Oliver A.H. Jones, Nathalie Dom, Julian L. Griffin, Wim De CoenEnvironment International 36 (2010) 254-268)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
Daphnia magna metabolite  A Daphnia metabolite produced by the species Daphnia magna.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
tricosanoic acid (CHEBI:42394) has role Daphnia magna metabolite (CHEBI:83056)
tricosanoic acid (CHEBI:42394) has role human metabolite (CHEBI:77746)
tricosanoic acid (CHEBI:42394) has role plant metabolite (CHEBI:76924)
tricosanoic acid (CHEBI:42394) is a straight-chain saturated fatty acid (CHEBI:39418)
tricosanoic acid (CHEBI:42394) is a very long-chain fatty acid (CHEBI:27283)
tricosanoic acid (CHEBI:42394) is conjugate acid of tricosanoate (CHEBI:79007)
Incoming Relation(s)
(3R,22R)-3,22-dihydroxytricosanoic acid (CHEBI:79255) has functional parent tricosanoic acid (CHEBI:42394)
(3R)-3,22-dihydroxytricosanoic acid (CHEBI:79299) has functional parent tricosanoic acid (CHEBI:42394)
N-(2-hydroxytricosanoyl)-D-galactosylsphingosine (CHEBI:83871) has functional parent tricosanoic acid (CHEBI:42394)
N-(tricosanoyl)-[(4E,6E)-tetradecasphingadienine]-1-phosphoethanolamine (CHEBI:86528) has functional parent tricosanoic acid (CHEBI:42394)
N-tricosanoyl-(4E,14Z)-sphinga-4,14-dienine (CHEBI:134552) has functional parent tricosanoic acid (CHEBI:42394)
N-tricosanoyl-D-galactosylsphingosine (CHEBI:83870) has functional parent tricosanoic acid (CHEBI:42394)
N-tricosanoyl-14-methylhexadecasphingosine (CHEBI:131542) has functional parent tricosanoic acid (CHEBI:42394)
N-tricosanoyl-14-methylhexadecasphingosine-1-phosphocholine (CHEBI:116932) has functional parent tricosanoic acid (CHEBI:42394)
N-tricosanoylsphing-4-enine-1-phosphocholine (CHEBI:83880) has functional parent tricosanoic acid (CHEBI:42394)
N-tricosanoylsphingadienine-1-phosphocholine (CHEBI:136283) has functional parent tricosanoic acid (CHEBI:42394)
N-tricosanoylsphinganine-1-phosphocholine (CHEBI:85017) has functional parent tricosanoic acid (CHEBI:42394)
N-tricosanoylsphingosine (CHEBI:84372) has functional parent tricosanoic acid (CHEBI:42394)
2-hydroxytricosanoic acid (CHEBI:84858) has functional parent tricosanoic acid (CHEBI:42394)
22-methyltricosanoic acid (CHEBI:84903) has functional parent tricosanoic acid (CHEBI:42394)
3,13,19-trimethyltricosanoic acid (CHEBI:188172) has functional parent tricosanoic acid (CHEBI:42394)
tricosanoyl-CoA (CHEBI:90266) has functional parent tricosanoic acid (CHEBI:42394)
α-D-Gal-(1→4)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d18:1/23:0) (CHEBI:84999) has functional parent tricosanoic acid (CHEBI:42394)
α-Neu5Ac-(2→3)-β-D-Gal-(1→3)-β-D-GalNAc-(1→4)-[α-Neu5Ac-(2→3)]-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d18:1/23:0) (CHEBI:84983) has functional parent tricosanoic acid (CHEBI:42394)
α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-Glc-(1↔1')-Cer(d18:1/23:0) (CHEBI:84988) has functional parent tricosanoic acid (CHEBI:42394)
β-D-galactosyl-(1→4)-β-D-glucosyl-(1↔1)-N-tricosanoylsphingosine (CHEBI:84763) has functional parent tricosanoic acid (CHEBI:42394)
β-D-galactosyl-N-(tricosanoyl)sphingosine (CHEBI:84742) has functional parent tricosanoic acid (CHEBI:42394)
β-D-glucosyl-(1↔1')-N-tricosanoyl-14-methylhexadecasphingosine (CHEBI:132780) has functional parent tricosanoic acid (CHEBI:42394)
β-D-glucosyl-(1↔1')-N-tricosanoyl-15-methylhexadecasphinganine (CHEBI:132787) has functional parent tricosanoic acid (CHEBI:42394)
β-D-glucosyl-N-(tricosanoyl)sphingosine (CHEBI:84741) has functional parent tricosanoic acid (CHEBI:42394)
22-tricosenoic acid (CHEBI:73736) has parent hydride tricosanoic acid (CHEBI:42394)
tricosanoate (CHEBI:79007) is conjugate base of tricosanoic acid (CHEBI:42394)
IUPAC Name 
tricosanoic acid
Synonym  Source
n-tricosanoic acidNIST Chemistry WebBook
Manual XrefsDatabases
LMFA01010023LIPID MAPS
F23PDBeChem
DB03500DrugBank
HMDB0001160HMDB
CPD-7834MetaCyc
Registry NumbersSources
Reaxys:1795192Reaxys
CAS:2433-96-7ChemIDplus
CAS:2433-96-7NIST Chemistry WebBook
Citations