EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C11H12NO9P |
| Net Charge | -2 |
| Average Mass | 333.189 |
| Monoisotopic Mass | 333.02606 |
| SMILES | O=C([O-])c1ccc[n+]([C@@H]2O[C@H](COP(=O)([O-])[O-])[C@@H](O)[C@H]2O)c1 |
| InChI | InChI=1S/C11H14NO9P/c13-8-7(5-20-22(17,18)19)21-10(9(8)14)12-3-1-2-6(4-12)11(15)16/h1-4,7-10,13-14H,5H2,(H2-,15,16,17,18,19)/p-2/t7-,8-,9-,10-/m1/s1 |
| InChIKey | JOUIQRNQJGXQDC-ZYUZMQFOSA-L |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | - | DOI (10.1038/nbt.2488) | |
| Saccharomyces cerevisiae (ncbitaxon:4932) | - | PubMed (24678285) | Source: yeast.sf.net |
| Roles Classification |
|---|
| Biological Roles: | human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| nicotinate D-ribonucleotide(2−) (CHEBI:57502) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) |
| nicotinate D-ribonucleotide(2−) (CHEBI:57502) has role human metabolite (CHEBI:77746) |
| nicotinate D-ribonucleotide(2−) (CHEBI:57502) is a organophosphate oxoanion (CHEBI:58945) |
| nicotinate D-ribonucleotide(2−) (CHEBI:57502) is conjugate base of nicotinic acid D-ribonucleotide (CHEBI:15763) |
| Incoming Relation(s) |
| nicotinic acid D-ribonucleotide (CHEBI:15763) is conjugate acid of nicotinate D-ribonucleotide(2−) (CHEBI:57502) |
| IUPAC Name |
|---|
| 1-(5-O-phosphonato-β-D-ribofuranosyl)pyridinium-3-carboxylate |
| Synonyms | Source |
|---|---|
| nicotinate D-ribonucleotide dianion | ChEBI |
| 3-carboxylato-1-(5-O-phosphonato-β-D-ribofuranosyl)pyridinium | ChEBI |
| UniProt Name | Source |
|---|---|
| nicotinate β-D-ribonucleotide | UniProt |