EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C14H18N4O2S |
| Net Charge | 0 |
| Average Mass | 306.391 |
| Monoisotopic Mass | 306.11505 |
| SMILES | COc1cc(Cc2cnc(N)nc2N)cc(OC)c1SC |
| InChI | InChI=1S/C14H18N4O2S/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18) |
| InChIKey | HRZQMMXCASMDBP-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Homo sapiens (ncbitaxon:9606) | feces (BTO:0000440) | MetaboLights (MTBLS9087) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| metioprim (CHEBI:229810) is a dimethoxybenzene (CHEBI:51681) |
| IUPAC Name |
|---|
| 5-[(3,5-dimethoxy-4-methylsulanylphenyl)methyl]pyrimidine-2,4-diamine |
| Manual Xrefs | Databases |
|---|---|
| HMDB0254675 | HMDB |
| 61858 | ChemSpider |
| D05005 | KEGG DRUG |