CHEBI:30772 - butyric acid

ChEBI IDCHEBI:30772
ChEBI Namebutyric acid
Stars
DefinitionA straight-chain saturated fatty acid that is butane in which one of the terminal methyl groups has been oxidised to a carboxy group.
Secondary ChEBI IDsCHEBI:3234, CHEBI:22948, CHEBI:41208, CHEBI:113450
Last Modified23 January 2020
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC4H8O2
Net Charge0
Average Mass88.106
Monoisotopic Mass88.05243
SMILESCCCC(=O)O
InChIInChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)
InChIKeyFERIUCNNQQJTOY-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
human urinary metabolite  Any metabolite (endogenous or exogenous) found in human urine samples.
Mycoplasma genitalium metabolite  Any bacterial metabolite produced during a metabolic reaction in Mycoplasma genitalium.
ChEBI Ontology
Outgoing Relation(s)
butyric acid (CHEBI:30772) has role Mycoplasma genitalium metabolite (CHEBI:131604)
butyric acid (CHEBI:30772) has role human urinary metabolite (CHEBI:84087)
butyric acid (CHEBI:30772) is a fatty acid 4:0 (CHEBI:140601)
butyric acid (CHEBI:30772) is a straight-chain saturated fatty acid (CHEBI:39418)
butyric acid (CHEBI:30772) is conjugate acid of butyrate (CHEBI:17968)
Incoming Relation(s)
(R)-2-hydroxy-4-(hydroxymethylphosphinyl)butyric acid (CHEBI:55544) has functional parent butyric acid (CHEBI:30772)
(R)-3-[(R)-3-hydroxybutanoyloxy]butanoic acid (CHEBI:17663) has functional parent butyric acid (CHEBI:30772)
(R)-3-hydroxy-2-oxo-4-phosphonooxybutanoic acid (CHEBI:27951) has functional parent butyric acid (CHEBI:30772)
(R)-3,4-dihydroxy-2-oxobutanoic acid (CHEBI:137486) has functional parent butyric acid (CHEBI:30772)
(S)-2-acetyl-2-hydroxybutanoic acid (CHEBI:27681) has functional parent butyric acid (CHEBI:30772)
(S)-2,4-dihydroxy-3-oxobutanoic acid (CHEBI:137502) has functional parent butyric acid (CHEBI:30772)
(S)-3,4-dihydroxy-2-oxobutanoic acid (CHEBI:137456) has functional parent butyric acid (CHEBI:30772)
(2S,3R)-2-[(3S,6R)-3-amino-6-hydroxy-2-oxopiperidinyl]-3-hydroxybutanoic acid (CHEBI:45661) has functional parent butyric acid (CHEBI:30772)
(2S)-2-[({4-[2-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]phenyl}carbonyl)amino]-4-(2H-tetrazol-5-yl)butanoic acid (CHEBI:43831) has functional parent butyric acid (CHEBI:30772)
(2S)-3-methyl-2-((2R,3S)-3-[(methylsulfonyl)amino]-1-{[2-(pyrrolidin-1-ylmethyl)-1,3-oxazol-4-yl]carbonyl}pyrrolidin-2-yl)butanoic acid (CHEBI:39551) has functional parent butyric acid (CHEBI:30772)
N-(butanoyl)ethanolamine (CHEBI:85304) has functional parent butyric acid (CHEBI:30772)
N-butanoylserotonin (CHEBI:134070) has functional parent butyric acid (CHEBI:30772)
N-butyryl-1-palmitoyl-2-linoleoyl-sn-glycero-3-phosphoethanolamine (CHEBI:85799) has functional parent butyric acid (CHEBI:30772)
O-butanoylcarnitine (CHEBI:7676) has functional parent butyric acid (CHEBI:30772)
S-butyryl-4'-phosphopantetheine (CHEBI:132309) has functional parent butyric acid (CHEBI:30772)
D-2,4-diaminobutyric acid (CHEBI:144635) has functional parent butyric acid (CHEBI:30772)
L-2-amino-4-(hydroxymethylphosphinoyl)butanoic acid (CHEBI:28030) has functional parent butyric acid (CHEBI:30772)
L-2,4-diaminobutyric acid (CHEBI:48950) has functional parent butyric acid (CHEBI:30772)
1-butyryl-2-oleoyl-sn-glycerol (CHEBI:75443) has functional parent butyric acid (CHEBI:30772)
1-palmitoyl-2-butanoyl-sn-glycero-3-phosphocholine (CHEBI:77832) has functional parent butyric acid (CHEBI:30772)
1,2-dibutyryl-sn-glycero-3-phospho-(1'D-myo-inositol-5'-phosphate) (CHEBI:83239) has functional parent butyric acid (CHEBI:30772)
1,2-dibutyryl-sn-glycero-3-phospho-(1'D-myo-inositol) (CHEBI:83240) has functional parent butyric acid (CHEBI:30772)
2-(hydroxymethyl)-4-oxobutanoic acid (CHEBI:17413) has functional parent butyric acid (CHEBI:30772)
2-acetyllactic acid (CHEBI:16444) has functional parent butyric acid (CHEBI:30772)
2-amino-2-hydroxybutanoic acid (CHEBI:74821) has functional parent butyric acid (CHEBI:30772)
2-amino-2-methylbutanoic acid (CHEBI:28075) has functional parent butyric acid (CHEBI:30772)
2-amino-3-oxobutanoic acid (CHEBI:17844) has functional parent butyric acid (CHEBI:30772)
2-hydroxybutyric acid (CHEBI:1148) has functional parent butyric acid (CHEBI:30772)
2-methylacetoacetic acid (CHEBI:37079) has functional parent butyric acid (CHEBI:30772)
2-oxobutanoic acid (CHEBI:30831) has functional parent butyric acid (CHEBI:30772)
2-phenylbutyric acid (CHEBI:86545) has functional parent butyric acid (CHEBI:30772)
2,2,4-trihydroxybutanoic acid (CHEBI:73967) has functional parent butyric acid (CHEBI:30772)
2,3-dihydroxy-3-methylbutanoic acid (CHEBI:15689) has functional parent butyric acid (CHEBI:30772)
2,4-diaminobutyric acid (CHEBI:64307) has functional parent butyric acid (CHEBI:30772)
3-(indol-3-yl)-2-oxobutyric acid (CHEBI:28549) has functional parent butyric acid (CHEBI:30772)
3-aminobutanoic acid (CHEBI:37081) has functional parent butyric acid (CHEBI:30772)
3-hydroxy-2-methylbutanoic acid (CHEBI:37051) has functional parent butyric acid (CHEBI:30772)
3-hydroxybutyric acid (CHEBI:20067) has functional parent butyric acid (CHEBI:30772)
3-hydroxyisovaleric acid (CHEBI:37084) has functional parent butyric acid (CHEBI:30772)
3-methyl-2-oxobutanoic acid (CHEBI:16530) has functional parent butyric acid (CHEBI:30772)
3,4-dihydroxybutyric acid (CHEBI:86371) has functional parent butyric acid (CHEBI:30772)
4-(2-amino-5-hydroxyphenyl)-2,4-dioxobutanoic acid (CHEBI:28350) has functional parent butyric acid (CHEBI:30772)
4-(2-aminophenyl)-2,4-dioxobutanoic acid (CHEBI:17442) has functional parent butyric acid (CHEBI:30772)
4-(2-thienyl)butyric acid (CHEBI:40114) has functional parent butyric acid (CHEBI:30772)
4-(5-ethyl-2-thienyl)-4-oxobutyric acid (CHEBI:64441) has functional parent butyric acid (CHEBI:30772)
4-(hydroxymethylphosphinyl)-2-oxobutyric acid (CHEBI:55526) has functional parent butyric acid (CHEBI:30772)
4-(methylamino)butyric acid (CHEBI:37755) has functional parent butyric acid (CHEBI:30772)
4-[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]butanoic acid (CHEBI:41198) has functional parent butyric acid (CHEBI:30772)
4-[4-(2,5-dioxopyrrolidin-1-yl)phenylamino]-4-hydroxybutyric acid (CHEBI:44860) has functional parent butyric acid (CHEBI:30772)
4-[4-(3,5-dioxohexyl)phenylcarbamoyl]butyric acid (CHEBI:63773) has functional parent butyric acid (CHEBI:30772)
4-guanidinobutanoic acid (CHEBI:15728) has functional parent butyric acid (CHEBI:30772)
4-hydroxybutyric acid (CHEBI:30830) has functional parent butyric acid (CHEBI:30772)
4-methylthio-2-oxobutanoic acid (CHEBI:33574) has functional parent butyric acid (CHEBI:30772)
4-oxo-4-(2-thienyl)butyric acid (CHEBI:64434) has functional parent butyric acid (CHEBI:30772)
4-oxo-4-phenylbutyric acid (CHEBI:64437) has functional parent butyric acid (CHEBI:30772)
4-phenylbutyric acid (CHEBI:41500) has functional parent butyric acid (CHEBI:30772)
acetoacetic acid (CHEBI:15344) has functional parent butyric acid (CHEBI:30772)
butyrate ester (CHEBI:50477) has functional parent butyric acid (CHEBI:30772)
butyryl-CoA (CHEBI:15517) has functional parent butyric acid (CHEBI:30772)
butyrylglycine (CHEBI:89963) has functional parent butyric acid (CHEBI:30772)
dibutyrin (CHEBI:76478) has functional parent butyric acid (CHEBI:30772)
dimethylbutyric acid (CHEBI:38648) has functional parent butyric acid (CHEBI:30772)
discadenine (CHEBI:15955) has functional parent butyric acid (CHEBI:30772)
heptafluorobutyric anhydride (CHEBI:39424) has functional parent butyric acid (CHEBI:30772)
hexyl butyrate (CHEBI:87559) has functional parent butyric acid (CHEBI:30772)
hydroxybutyric acid (CHEBI:24684) has functional parent butyric acid (CHEBI:30772)
indole-3-butyric acid (CHEBI:33070) has functional parent butyric acid (CHEBI:30772)
isooctanediol dibutyrate (CHEBI:88828) has functional parent butyric acid (CHEBI:30772)
methionine (CHEBI:16811) has functional parent butyric acid (CHEBI:30772)
methylbutyric acid (CHEBI:38653) has functional parent butyric acid (CHEBI:30772)
monobutyrin (CHEBI:76503) has functional parent butyric acid (CHEBI:30772)
perfluorobutyric acid (CHEBI:39426) has functional parent butyric acid (CHEBI:30772)
perquinoline A (CHEBI:156391) has functional parent butyric acid (CHEBI:30772)
perquinoline C (CHEBI:156393) has functional parent butyric acid (CHEBI:30772)
tributyrin (CHEBI:35020) has functional parent butyric acid (CHEBI:30772)
α-amino-γ-cyanobutanoic acid (CHEBI:27578) has functional parent butyric acid (CHEBI:30772)
α-aminobutyric acid (CHEBI:35621) has functional parent butyric acid (CHEBI:30772)
γ-amino-β-hydroxybutyric acid (CHEBI:16080) has functional parent butyric acid (CHEBI:30772)
γ-amino-γ-cyanobutanoic acid (CHEBI:28474) has functional parent butyric acid (CHEBI:30772)
γ-aminobutyric acid (CHEBI:16865) has functional parent butyric acid (CHEBI:30772)
butyrate (CHEBI:17968) is conjugate base of butyric acid (CHEBI:30772)
butyryl group (CHEBI:22972) is substituent group from butyric acid (CHEBI:30772)
IUPAC Name 
butanoic acid
Synonyms  Source
1-butanoic acidHMDB
1-butyric acidHMDB
1-propanecarboxylic acidMetaCyc
4:0ChEBI
acide butanoïqueIUPAC
acide butyriqueChEBI
Manual XrefsDatabases
BUAPDBeChem
Butyric_acidWikipedia
BUTYRIC_ACIDMetaCyc
C00001180KNApSAcK
C00246KEGG COMPOUND
DB03568DrugBank
HMDB0000039HMDB
LMFA01010004LIPID MAPS
Registry NumbersSources
Gmelin:26242Gmelin
Reaxys:906770Reaxys
CAS:107-92-6KEGG COMPOUND
CAS:107-92-6ChemIDplus
CAS:107-92-6NIST Chemistry WebBook
Citations