EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:225191 - Epicoccin P
| Formula | C19H24N2O6S2 |
| Net Charge | 0 |
| Average Mass | 440.543 |
| Monoisotopic Mass | 440.10758 |
| SMILES | CS[C@@]12C[C@H]3[C@@H]([C@@H](O)CC[C@@H]3O)N1C(=O)[C@]13C[C@H]4C(=O)[C@H](C[C@H](O)[C@H]4N1C2=O)S3 |
| InChI | InChI=1S/C19H24N2O6S2/c1-28-18-5-7-9(22)2-3-10(23)13(7)20(18)17(27)19-6-8-14(21(19)16(18)26)11(24)4-12(29-19)15(8)25/h7-14,22-24H,2-6H2,1H3/t7-,8-,9+,10+,11+,12+,13+,14+,18-,19-/m1/s1 |
| InChIKey | UQUQAJOQSLPCBH-OZJOOMBYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Epicoccum nigrum (ncbitaxon:105696) | - | PubMed (20550196) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Epicoccin P (CHEBI:225191) has functional parent α-amino acid (CHEBI:33704) |
| Epicoccin P (CHEBI:225191) is a organonitrogen compound (CHEBI:35352) |
| Epicoccin P (CHEBI:225191) is a organooxygen compound (CHEBI:36963) |
| IUPAC Name |
|---|
| (1R,4S,5S,8S,9S,11R,14S,15S,17S,19R)-5,8,15-trihydroxy-11-methylsulanyl-21-thia-3,13-diazahexacyclo[15.3.1.01,13.03,11.04,9.014,19]henicosane-2,12,18-trione |