EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H17N3O3 |
| Net Charge | 0 |
| Average Mass | 239.275 |
| Monoisotopic Mass | 239.12699 |
| SMILES | C=C1C[C@@H](C(=O)N[C@H](C(=O)O)C(C)C)N=C1N |
| InChI | InChI=1S/C11H17N3O3/c1-5(2)8(11(16)17)14-10(15)7-4-6(3)9(12)13-7/h5,7-8H,3-4H2,1-2H3,(H2,12,13)(H,14,15)(H,16,17)/t7-,8-/m0/s1 |
| InChIKey | ZUBOMWJCMSHMTA-YUMQZZPRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Burkholderia plantarii (ncbitaxon:41899) | - | PubMed (16172692) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-imino-3-methylene-5-L-(carboxy-L-valyl)pyrrolidine (CHEBI:221635) is a valine derivative (CHEBI:27267) |
| IUPAC Name |
|---|
| (2S)-2-[[(2S)-5-amino-4-methylidene-2,3-dihydropyrrole-2-carbonyl]amino]-3-methylbutanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 9862066 | ChemSpider |