EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C8H11NO2 |
| Net Charge | 0 |
| Average Mass | 153.181 |
| Monoisotopic Mass | 153.07898 |
| SMILES | COC(=O)c1cc(C)nc1C |
| InChI | InChI=1S/C8H11NO2/c1-5-4-7(6(2)9-5)8(10)11-3/h4,9H,1-3H3 |
| InChIKey | OQWZEJIISPYZPW-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Bombus terrestris (ncbitaxon:30195) | |||
| hindgut (BTO:0000510) | MetaboLights (MTBLS3637) | ||
| hemolymph (BTO:0000572) | MetaboLights (MTBLS3637) | ||
| brain (BTO:0000142) | MetaboLights (MTBLS3637) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate (CHEBI:183474) is a pyrroles (CHEBI:26455) |
| IUPAC Name |
|---|
| methyl 2,5-dimethyl-1H-pyrrole-3-carboxylate |
| Manual Xrefs | Databases |
|---|---|
| 515258 | ChemSpider |