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CHEBI:37084 - 3-hydroxyisovaleric acid
| Formula | C5H10O3 |
| Net Charge | 0 |
| Average Mass | 118.132 |
| Monoisotopic Mass | 118.06299 |
| SMILES | CC(C)(O)CC(=O)O |
| InChI | InChI=1S/C5H10O3/c1-5(2,8)3-4(6)7/h8H,3H2,1-2H3,(H,6,7) |
| InChIKey | AXFYFNCPONWUHW-UHFFFAOYSA-N |
| Wikipedia |
|---|
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | - | PubMed (12399279) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-hydroxyisovaleric acid (CHEBI:37084) has functional parent butyric acid (CHEBI:30772) |
| 3-hydroxyisovaleric acid (CHEBI:37084) has functional parent isovaleric acid (CHEBI:28484) |
| 3-hydroxyisovaleric acid (CHEBI:37084) has role human metabolite (CHEBI:77746) |
| 3-hydroxyisovaleric acid (CHEBI:37084) is a 3-hydroxy monocarboxylic acid (CHEBI:35969) |
| 3-hydroxyisovaleric acid (CHEBI:37084) is conjugate acid of 3-hydroxyisovalerate (CHEBI:82957) |
| Incoming Relation(s) |
| 3-hydroxyisovaleryl-CoA (CHEBI:28291) has functional parent 3-hydroxyisovaleric acid (CHEBI:37084) |
| 3-hydroxyisovalerylcarnitine (CHEBI:73027) has functional parent 3-hydroxyisovaleric acid (CHEBI:37084) |
| 3-hydroxyisovalerate (CHEBI:82957) is conjugate base of 3-hydroxyisovaleric acid (CHEBI:37084) |
| IUPAC Name |
|---|
| 3-hydroxy-3-methylbutanoic acid |
| Synonyms | Source |
|---|---|
| beta-Hydroxyisovaleric acid | ChemIDplus |
| Hmb-d6 | ChemIDplus |
| HMB | ChEBI |
| 3-hydroxy-3-methylbutyric acid | ChEBI |
| β-hydroxy-β-methylbutyric acid | ChEBI |
| 3-OH-isovaleric acid | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| Beta-Hydroxy_beta-methylbutyric_acid | Wikipedia |
| HMDB0000754 | HMDB |
| LMFA01050396 | LIPID MAPS |
| Registry Numbers | Sources |
|---|---|
| Reaxys:1743952 | Reaxys |
| CAS:625-08-1 | ChemIDplus |
| Citations |
|---|