EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C20H22N2O5S2 |
| Net Charge | 0 |
| Average Mass | 434.539 |
| Monoisotopic Mass | 434.09701 |
| SMILES | CS[C@@]12C[C@@H]3C(=O)C=C[C@H](O)[C@H]3N1C(=O)[C@]1(SC)CC3=CC=C[C@H](O)[C@H]3N1C2=O |
| InChI | InChI=1S/C20H22N2O5S2/c1-28-19-8-10-4-3-5-13(24)15(10)21(19)18(27)20(29-2)9-11-12(23)6-7-14(25)16(11)22(20)17(19)26/h3-7,11,13-16,24-25H,8-9H2,1-2H3/t11-,13+,14+,15+,16+,19-,20-/m1/s1 |
| InChIKey | NUAHASFAPHZEMJ-FIFUOPKPSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Eutypella (ncbitaxon:140192) | - | DOI (10.1039/c7ra05774a) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Eutypellazine E (CHEBI:207265) has functional parent α-amino acid (CHEBI:33704) |
| Eutypellazine E (CHEBI:207265) is a organonitrogen compound (CHEBI:35352) |
| Eutypellazine E (CHEBI:207265) is a organooxygen compound (CHEBI:36963) |
| IUPAC Name |
|---|
| (1R,4S,5S,9S,11R,14S,15S)-5,15-dihydroxy-1,11-bis(methylsulanyl)-3,13-diazapentacyclo[11.7.0.03,11.04,9.014,19]icosa-6,16,18-triene-2,8,12-trione |
| Manual Xrefs | Databases |
|---|---|
| 62277930 | ChemSpider |