EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C8H9NO3 |
| Net Charge | 0 |
| Average Mass | 167.164 |
| Monoisotopic Mass | 167.05824 |
| SMILES | [H]C(=O)c1c(CO)cnc(C)c1O |
| InChI | InChI=1S/C8H9NO3/c1-5-8(12)7(4-11)6(3-10)2-9-5/h2,4,10,12H,3H2,1H3 |
| InChIKey | RADKZDMFGJYCBB-UHFFFAOYSA-N |
| Wikipedia |
|---|
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | |||
| - | DOI (10.1038/nbt.2488) | ||
| blood (UBERON:0000178) | Article (Geigy Scientific Tables, 8th Rev edition, pp. 165-177. Edited by C. Lentner, West Cadwell, N.J.: Medical education Div., Ciba-Geigy Corp., Basel, Switzerland c1981-1992.) | ||
| - | MetaboLights (MTBLS20) | From MetaboLights | |
| Saccharomyces cerevisiae (ncbitaxon:4932) | - | PubMed (24678285) | Source: yeast.sf.net |
| Escherichia coli (ncbitaxon:562) | - | PubMed (21988831) | |
| Mus musculus (ncbitaxon:10090) | |||
| - | PubMed (19425150) | Source: BioModels - MODEL1507180067 | |
| - | MetaboLights (MTBLS376) | From MetaboLights Strain: C57bl/6 mouse (NCIT:C14424) | |
| Trypanosoma brucei (ncbitaxon:5691) | - | MetaboLights (MTBLS49) | From MetaboLights |
| Daphnia pulex (ncbitaxon:6669) | - | MetaboLights (MTBLS259) | From MetaboLights |
| Roles Classification |
|---|
| Biological Roles: | cofactor An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group). mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). water-soluble vitamin (role) Any vitamin that dissolves in water and readily absorbed into tissues for immediate use. Unlike the fat-soluble vitamins, they are not stored in the body and need to be replenished regularly in the diet and will rarely accumulate to toxic levels since they are quickly excreted from the body via urine. |
| Application: | nutraceutical A product in capsule, tablet or liquid form that provide essential nutrients, such as a vitamin, an essential mineral, a protein, an herb, or similar nutritional substance. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| pyridoxal (CHEBI:17310) has role Escherichia coli metabolite (CHEBI:76971) |
| pyridoxal (CHEBI:17310) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) |
| pyridoxal (CHEBI:17310) has role cofactor (CHEBI:23357) |
| pyridoxal (CHEBI:17310) has role human metabolite (CHEBI:77746) |
| pyridoxal (CHEBI:17310) has role mouse metabolite (CHEBI:75771) |
| pyridoxal (CHEBI:17310) is a hydroxymethylpyridine (CHEBI:38196) |
| pyridoxal (CHEBI:17310) is a methylpyridines (CHEBI:25340) |
| pyridoxal (CHEBI:17310) is a monohydroxypyridine (CHEBI:38182) |
| pyridoxal (CHEBI:17310) is a pyridinecarbaldehyde (CHEBI:38187) |
| pyridoxal (CHEBI:17310) is a vitamin B6 (CHEBI:27306) |
| pyridoxal (CHEBI:17310) is conjugate base of pyridoxal(1+) (CHEBI:131530) |
| Incoming Relation(s) |
| N-(5'-phosphopyridoxyl)-D-alanine (CHEBI:44743) has functional parent pyridoxal (CHEBI:17310) |
| N-(5'-phosphopyridoxyl)-L-alanine (CHEBI:44770) has functional parent pyridoxal (CHEBI:17310) |
| N2-(5'-phosphopyridoxyl)-L-lysine (CHEBI:44759) has functional parent pyridoxal (CHEBI:17310) |
| N6-(pyridoxal phosphate)-L-lysine (CHEBI:134066) has functional parent pyridoxal (CHEBI:17310) |
| N6-acetyl-N2-(5'-phosphopyridoxyl)-L-lysine (CHEBI:59767) has functional parent pyridoxal (CHEBI:17310) |
| pyridoxal 5'-phosphate (CHEBI:18405) has functional parent pyridoxal (CHEBI:17310) |
| pyridoxal(1+) (CHEBI:131530) is conjugate acid of pyridoxal (CHEBI:17310) |
| IUPAC Name |
|---|
| 3-hydroxy-5-(hydroxymethyl)-2-methylpyridine-4-carbaldehyde |
| Synonyms | Source |
|---|---|
| Pyridoxal | KEGG COMPOUND |
| pyridoxaldehyde | ChemIDplus |
| 3-HYDROXY-5-(HYDROXYMETHYL)-2-METHYLISONICOTINALDEHYDE | PDBeChem |
| UniProt Name | Source |
|---|---|
| pyridoxal | UniProt |
| Citations |
|---|