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CHEBI:33199 - propynoic acid
| Formula | C3H2O2 |
| Net Charge | 0 |
| Average Mass | 70.047 |
| Monoisotopic Mass | 70.00548 |
| SMILES | C#CC(=O)O |
| InChI | InChI=1S/C3H2O2/c1-2-3(4)5/h1H,(H,4,5) |
| InChIKey | UORVCLMRJXCDCP-UHFFFAOYSA-N |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| Biological Role: | xenobiotic metabolite Any metabolite produced by metabolism of a xenobiotic compound. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| propynoic acid (CHEBI:33199) has role xenobiotic metabolite (CHEBI:76206) |
| propynoic acid (CHEBI:33199) is a acetylenic fatty acid (CHEBI:25380) |
| propynoic acid (CHEBI:33199) is a monounsaturated fatty acid (CHEBI:25413) |
| propynoic acid (CHEBI:33199) is a short-chain fatty acid (CHEBI:26666) |
| propynoic acid (CHEBI:33199) is a terminal acetylenic compound (CHEBI:73477) |
| propynoic acid (CHEBI:33199) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020) |
| propynoic acid (CHEBI:33199) is conjugate acid of propynoate (CHEBI:15364) |
| Incoming Relation(s) |
| phenylpropiolic acid (CHEBI:90355) has functional parent propynoic acid (CHEBI:33199) |
| propynamide (CHEBI:51764) has functional parent propynoic acid (CHEBI:33199) |
| propynoate (CHEBI:15364) is conjugate base of propynoic acid (CHEBI:33199) |
| IUPAC Name |
|---|
| prop-2-ynoic acid |
| Synonyms | Source |
|---|---|
| Propiolic acid | KEGG COMPOUND |
| Acetylenecarboxylic acid | KEGG COMPOUND |
| 2-propynoic acid | NIST Chemistry WebBook |
| carboxyacetylene | NIST Chemistry WebBook |
| propargylic acid | NIST Chemistry WebBook |
| HC≡CCOOH | NIST Chemistry WebBook |
| Manual Xrefs | Databases |
|---|---|
| C00804 | KEGG COMPOUND |
| HMDB0006804 | HMDB |
| Citations |
|---|