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CHEBI:48569 - γ-valerolactone
| Formula | C5H8O2 |
| Net Charge | 0 |
| Average Mass | 100.117 |
| Monoisotopic Mass | 100.05243 |
| SMILES | CC1CCC(=O)O1 |
| InChI | InChI=1S/C5H8O2/c1-4-2-3-5(6)7-4/h4H,2-3H2,1H3 |
| InChIKey | GAEKPEKOJKCEMS-UHFFFAOYSA-N |
| Wikipedia |
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| Roles Classification |
|---|
| Biological Roles: | human xenobiotic metabolite Any human metabolite produced by metabolism of a xenobiotic compound in humans. flavouring agent A food additive that is used to added improve the taste or odour of a food. |
| Application: | flavouring agent A food additive that is used to added improve the taste or odour of a food. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| γ-valerolactone (CHEBI:48569) has role flavouring agent (CHEBI:35617) |
| γ-valerolactone (CHEBI:48569) has role human xenobiotic metabolite (CHEBI:76967) |
| γ-valerolactone (CHEBI:48569) is a butan-4-olide (CHEBI:22950) |
| Incoming Relation(s) |
| 5-(3',4'-dihydroxyphenyl)-γ-valerolactone 3'-O-sulfate (CHEBI:134254) has functional parent γ-valerolactone (CHEBI:48569) |
| 5-(3',4',5'-trihydroxyphenyl)-γ-valerolactone (CHEBI:134255) has functional parent γ-valerolactone (CHEBI:48569) |
| (R)-γ-valerolactone (CHEBI:48570) is a γ-valerolactone (CHEBI:48569) |
| (S)-γ-valerolactone (CHEBI:48571) is a γ-valerolactone (CHEBI:48569) |
| IUPAC Name |
|---|
| 5-methyldihydrofuran-2(3H)-one |
| Synonyms | Source |
|---|---|
| 4-Hydroxypentanoic acid lactone | ChemIDplus |
| 4-Hydroxyvaleric acid lactone | ChemIDplus |
| 4-Methyl-4-hydroxybutanoic acid lactone | ChemIDplus |
| 4-Methyl-γ-butyrolactone | NIST Chemistry WebBook |
| 4-Pentanolide | ChemIDplus |
| 4-Valerolactone | ChemIDplus |
| Manual Xrefs | Databases |
|---|---|
| CN101633649 | Patent |
| Gamma-Valerolactone | Wikipedia |
| HMDB0033840 | HMDB |
| Citations |
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