EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H17NO4 |
| Net Charge | 0 |
| Average Mass | 251.282 |
| Monoisotopic Mass | 251.11576 |
| SMILES | C[C@]12CC(=O)N[C@@]1([C@@H](O)[C@@H]1C=CCCC1)C(=O)O2 |
| InChI | InChI=1S/C13H17NO4/c1-12-7-9(15)14-13(12,11(17)18-12)10(16)8-5-3-2-4-6-8/h3,5,8,10,16H,2,4,6-7H2,1H3,(H,14,15)/t8-,10+,12+,13+/m1/s1 |
| InChIKey | AYOGRQFSCAQCLR-UKWYHXRUSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Salinispora (ncbitaxon:168694) | - | PubMed (21154492) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Salinosporamide K (CHEBI:207450) has functional parent α-amino acid (CHEBI:33704) |
| Salinosporamide K (CHEBI:207450) is a organonitrogen compound (CHEBI:35352) |
| Salinosporamide K (CHEBI:207450) is a organooxygen compound (CHEBI:36963) |
| IUPAC Name |
|---|
| (1R,5S)-1-[(S)-[(1S)-cyclohex-2-en-1-yl]-hydroxymethyl]-5-methyl-6-oxa-2-azabicyclo[3.2.0]heptane-3,7-dione |
| Manual Xrefs | Databases |
|---|---|
| 28185150 | ChemSpider |