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CHEBI:30813 - decanoic acid

ChEBI IDCHEBI:30813
ChEBI Namedecanoic acid
Stars
DefinitionA C10, straight-chain saturated fatty acid.
Secondary ChEBI IDsCHEBI:4347, CHEBI:23572, CHEBI:41906
Last Modified10 August 2021
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC10H20O2
Net Charge0
Average Mass172.268
Monoisotopic Mass172.14633
SMILESCCCCCCCCCC(=O)O
InChIInChI=1S/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
InChIKeyGHVNFZFCNZKVNT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - PubMed (9459379)
Cistus creticus (ncbitaxon:191224) - DOI (10.1016/j.phytochem.2009.06.013)
Chlamydomonas reinhardtii (ncbitaxon:3055) - PubMed (25515814)
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.
algal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in algae including unicellular organisms like chlorella and diatoms to multicellular organisms like giant kelps and brown algae.
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
antibacterial agent  A substance (or active part thereof) that kills or slows the growth of bacteria.
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
Application:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
ChEBI Ontology
Outgoing Relation(s)
decanoic acid (CHEBI:30813) has parent hydride decane (CHEBI:41808)
decanoic acid (CHEBI:30813) has role algal metabolite (CHEBI:84735)
decanoic acid (CHEBI:30813) has role anti-inflammatory agent (CHEBI:67079)
decanoic acid (CHEBI:30813) has role antibacterial agent (CHEBI:33282)
decanoic acid (CHEBI:30813) has role human metabolite (CHEBI:77746)
decanoic acid (CHEBI:30813) has role plant metabolite (CHEBI:76924)
decanoic acid (CHEBI:30813) has role volatile oil component (CHEBI:27311)
decanoic acid (CHEBI:30813) is a medium-chain fatty acid (CHEBI:59554)
decanoic acid (CHEBI:30813) is a straight-chain saturated fatty acid (CHEBI:39418)
decanoic acid (CHEBI:30813) is conjugate acid of decanoate (CHEBI:27689)
Incoming Relation(s)
(R)-3-hydroxydecanoyl-CoA (CHEBI:74405) has functional parent decanoic acid (CHEBI:30813)
(S)-3-hydroxydecanoic acid (CHEBI:37371) has functional parent decanoic acid (CHEBI:30813)
(S)-3-hydroxydecanoyl-CoA (CHEBI:28325) has functional parent decanoic acid (CHEBI:30813)
(3S,4S)-3-hydroxy-4-methyldecanoic acid (CHEBI:71005) has functional parent decanoic acid (CHEBI:30813)
(9R)-9-hydroxydecanoic acid (CHEBI:78951) has functional parent decanoic acid (CHEBI:30813)
N-(decanoyl)ethanolamine (CHEBI:85301) has functional parent decanoic acid (CHEBI:30813)
N-capryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85796) has functional parent decanoic acid (CHEBI:30813)
N-decanoyl-(2S)-hydroxyglycine (CHEBI:142744) has functional parent decanoic acid (CHEBI:30813)
N-decanoylglycine (CHEBI:74430) has functional parent decanoic acid (CHEBI:30813)
N-decanoylsphingosine (CHEBI:72955) has functional parent decanoic acid (CHEBI:30813)
N-decanoylsphingosine 1-phosphate (CHEBI:73147) has functional parent decanoic acid (CHEBI:30813)
S-decanoyl-4'-phosphopantetheine (CHEBI:132313) has functional parent decanoic acid (CHEBI:30813)
1-O-(α-D-galactosyl)-N-decanoylphytosphingosine (CHEBI:84160) has functional parent decanoic acid (CHEBI:30813)
10-hydroxycapric acid (CHEBI:17409) has functional parent decanoic acid (CHEBI:30813)
10-oxocapric acid (CHEBI:17130) has functional parent decanoic acid (CHEBI:30813)
2-hydroxydecanoic acid (CHEBI:133172) has functional parent decanoic acid (CHEBI:30813)
2-oxodecanoic acid (CHEBI:34301) has functional parent decanoic acid (CHEBI:30813)
3-hydroxydecanoic acid (CHEBI:132983) has functional parent decanoic acid (CHEBI:30813)
3-oxodecanoic acid (CHEBI:37157) has functional parent decanoic acid (CHEBI:30813)
caprate phytyl ester (CHEBI:177028) has functional parent decanoic acid (CHEBI:30813)
decanamide (CHEBI:38833) has functional parent decanoic acid (CHEBI:30813)
decanoate ester (CHEBI:87658) has functional parent decanoic acid (CHEBI:30813)
decanoyl-CoA (CHEBI:28493) has functional parent decanoic acid (CHEBI:30813)
decanoylcholine (CHEBI:74107) has functional parent decanoic acid (CHEBI:30813)
perfluorodecanoic acid (CHEBI:35546) has functional parent decanoic acid (CHEBI:30813)
pescaprein XXIV (CHEBI:67854) has functional parent decanoic acid (CHEBI:30813)
pescaprein XXVI (CHEBI:67856) has functional parent decanoic acid (CHEBI:30813)
propyl decanoate (CHEBI:86973) has functional parent decanoic acid (CHEBI:30813)
decanoate (CHEBI:27689) is conjugate base of decanoic acid (CHEBI:30813)
decanoyl group (CHEBI:23574) is substituent group from decanoic acid (CHEBI:30813)
IUPAC Name 
decanoic acid
Synonyms  Source
n-Capric acidKEGG COMPOUND
Decanoic acidKEGG COMPOUND
Decylic acidKEGG COMPOUND
caprinic acidNIST Chemistry WebBook
n-decanoic acidNIST Chemistry WebBook
decoic acidNIST Chemistry WebBook
Manual XrefsDatabases
C01571KEGG COMPOUND
DKAPDBeChem
LMFA01010010LIPID MAPS
DB03600DrugBank
C00001213KNApSAcK
CPD-3617MetaCyc
YMDB00677YMDB
ECMDB21204ECMDB
HMDB0000511HMDB
Registry NumbersSources
Beilstein:1754556Beilstein
Gmelin:69184Gmelin
CAS:334-48-5KEGG COMPOUND
CAS:334-48-5ChemIDplus
CAS:334-48-5NIST Chemistry WebBook
Citations