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CHEBI:29750 - 3-(indol-3-yl)pyruvic acid
| Formula | C11H9NO3 |
| Net Charge | 0 |
| Average Mass | 203.197 |
| Monoisotopic Mass | 203.05824 |
| SMILES | O=C(O)C(=O)Cc1cnc2ccccc12 |
| InChI | InChI=1S/C11H9NO3/c13-10(11(14)15)5-7-6-12-9-4-2-1-3-8(7)9/h1-4,6,12H,5H2,(H,14,15) |
| InChIKey | RSTKLPZEZYGQPY-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Saccharomyces cerevisiae (ncbitaxon:4932) | - | PubMed (12902239) |
| 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. Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(indol-3-yl)pyruvic acid (CHEBI:29750) has functional parent pyruvic acid (CHEBI:32816) |
| 3-(indol-3-yl)pyruvic acid (CHEBI:29750) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) |
| 3-(indol-3-yl)pyruvic acid (CHEBI:29750) has role plant metabolite (CHEBI:76924) |
| 3-(indol-3-yl)pyruvic acid (CHEBI:29750) is a 2-oxo monocarboxylic acid (CHEBI:35910) |
| 3-(indol-3-yl)pyruvic acid (CHEBI:29750) is a indol-3-yl carboxylic acid (CHEBI:24810) |
| 3-(indol-3-yl)pyruvic acid (CHEBI:29750) is conjugate acid of 3-(indol-3-yl)pyruvate (CHEBI:17640) |
| Incoming Relation(s) |
| 3-(indol-3-yl)pyruvate (CHEBI:17640) is conjugate base of 3-(indol-3-yl)pyruvic acid (CHEBI:29750) |
| IUPAC Name |
|---|
| 3-(1H-indol-3-yl)-2-oxopropanoic acid |
| Synonyms | Source |
|---|---|
| Indolepyruvic acid | KEGG COMPOUND |
| indole-3-pyruvic acid | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| C00331 | KEGG COMPOUND |
| C00331 | KEGG COMPOUND |
| 3IO | PDBeChem |
| HMDB0060484 | HMDB |
| ECMDB21543 | ECMDB |
| YMDB00169 | YMDB |
| C00007571 | KNApSAcK |
| Registry Numbers | Sources |
|---|---|
| Reaxys:172966 | Reaxys |
| CAS:392-12-1 | KEGG COMPOUND |
| CAS:392-12-1 | ChemIDplus |
| Citations |
|---|