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CHEBI:179632 - 2,8-dioxoadenine
| Formula | C5H5N5O2 |
| Net Charge | 0 |
| Average Mass | 167.128 |
| Monoisotopic Mass | 167.04432 |
| SMILES | Nc1nc(=O)nc2nc(=O)nc12 |
| InChI | InChI=1S/C5H5N5O2/c6-2-1-3(9-4(11)7-1)10-5(12)8-2/h(H5,6,7,8,9,10,11,12) |
| InChIKey | XFBOJHLYDJZYSP-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Canis lupus familiaris (ncbitaxon:9615) | blood plasma (BTO:0000118) | PubMed (4643620) | |
| Homo sapiens (ncbitaxon:9606) | urine (BTO:0001419) | PubMed (1091029) | |
| Macaca fascicularis (ncbitaxon:9541) | - | PubMed (4989592) | Species also known as Macaca irus. |
| Roles Classification |
|---|
| Biological Roles: | mammalian metabolite Any animal metabolite produced during a metabolic reaction in mammals. nephrotoxic agent A role played by any chemical compound (natural or synthetic) exhibiting itself through the ability to induce damage to the kidneys. human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2,8-dioxoadenine (CHEBI:179632) has functional parent adenine (CHEBI:16708) |
| 2,8-dioxoadenine (CHEBI:179632) has role human urinary metabolite (CHEBI:84087) |
| 2,8-dioxoadenine (CHEBI:179632) has role mammalian metabolite (CHEBI:75768) |
| 2,8-dioxoadenine (CHEBI:179632) has role nephrotoxic agent (CHEBI:50909) |
| 2,8-dioxoadenine (CHEBI:179632) is a 6-aminopurines (CHEBI:20706) |
| 2,8-dioxoadenine (CHEBI:179632) is a oxopurine (CHEBI:25810) |
| 2,8-dioxoadenine (CHEBI:179632) is tautomer of 2,8-dihydroxyadenine (CHEBI:183641) |
| Incoming Relation(s) |
| 2,8-dihydroxyadenine (CHEBI:183641) is tautomer of 2,8-dioxoadenine (CHEBI:179632) |
| IUPAC Name |
|---|
| 6-amino-1H-purine-2,8(7H,9H)-dione |
| Synonym | Source |
|---|---|
| 2,8-dioxyadenine | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| 83302 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:30377-37-8 | ChemIDplus |
| Citations |
|---|