EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H18N2O3 |
| Net Charge | 0 |
| Average Mass | 214.265 |
| Monoisotopic Mass | 214.13174 |
| SMILES | CC(C)C[C@@]1(C(N)=O)NC(=O)C[C@]1(C)O |
| InChI | InChI=1S/C10H18N2O3/c1-6(2)4-10(8(11)14)9(3,15)5-7(13)12-10/h6,15H,4-5H2,1-3H3,(H2,11,14)(H,12,13)/t9-,10-/m0/s1 |
| InChIKey | SNBONYSNCLHAOU-UWVGGRQHSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Monascus purpureus (ncbitaxon:5098) | - | PubMed (28026946) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Monascustin (CHEBI:206560) is a pyrroline (CHEBI:23763) |
| IUPAC Name |
|---|
| (2R,3S)-3-hydroxy-3-methyl-2-(2-methylpropyl)-5-oxopyrrolidine-2-carboxamide |
| Manual Xrefs | Databases |
|---|---|
| 58826989 | ChemSpider |