EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H36N4O6 |
| Net Charge | 0 |
| Average Mass | 452.552 |
| Monoisotopic Mass | 452.26348 |
| SMILES | CC(C)C[C@@H]1NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC(C)C)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O |
| InChI | InChI=1S/C22H36N4O6/c1-11(2)5-15-21(31)25-9-13(27)8-18(25)20(30)24-16(6-12(3)4)22(32)26-10-14(28)7-17(26)19(29)23-15/h11-18,27-28H,5-10H2,1-4H3,(H,23,29)(H,24,30)/t13-,14-,15-,16+,17+,18+/m1/s1 |
| InChIKey | GFPWUVSZMLDPAF-ZXLDYLNASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Phomopsis (ncbitaxon:34399) | - | PubMed (24571709) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cyclo-(L-leucyl-trans-4-hydroxy-L-prolyl-D-leucyl-trans-4-hydroxy-L-proline) (CHEBI:212817) has functional parent α-amino acid (CHEBI:33704) |
| Cyclo-(L-leucyl-trans-4-hydroxy-L-prolyl-D-leucyl-trans-4-hydroxy-L-proline) (CHEBI:212817) is a organonitrogen compound (CHEBI:35352) |
| Cyclo-(L-leucyl-trans-4-hydroxy-L-prolyl-D-leucyl-trans-4-hydroxy-L-proline) (CHEBI:212817) is a organooxygen compound (CHEBI:36963) |
| IUPAC Name |
|---|
| (3R,6S,8R,12S,15S,17R)-8,17-dihydroxy-3,12-bis(2-methylpropyl)-1,4,10,13-tetrazatricyclo[13.3.0.06,10]octadecane-2,5,11,14-tetrone |
| Manual Xrefs | Databases |
|---|---|
| 32675011 | ChemSpider |