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CHEBI:204518 - Spirotryprostatin E
| Formula | C27H33N3O8 |
| Net Charge | 0 |
| Average Mass | 527.574 |
| Monoisotopic Mass | 527.22677 |
| SMILES | COc1ccc2c(c1)N(/C=C/C(C)(C)OO)C(=O)[C@]21[C@H](C=C(C)C)N2C(=O)[C@@H]3CCCN3C(=O)[C@]2(O)[C@H]1O |
| InChI | InChI=1S/C27H33N3O8/c1-15(2)13-20-26(22(32)27(35)24(34)28-11-6-7-18(28)21(31)30(20)27)17-9-8-16(37-5)14-19(17)29(23(26)33)12-10-25(3,4)38-36/h8-10,12-14,18,20,22,32,35-36H,6-7,11H2,1-5H3/b12-10+/t18-,20-,22-,26-,27+/m0/s1 |
| InChIKey | JJLSZLCTSPLZGO-VDHBQYSBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus fumigatus (ncbitaxon:746128) | - | DOI (10.1016/j.tet.2008.06.013) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Spirotryprostatin E (CHEBI:204518) has functional parent α-amino acid (CHEBI:33704) |
| Spirotryprostatin E (CHEBI:204518) is a organonitrogen compound (CHEBI:35352) |
| Spirotryprostatin E (CHEBI:204518) is a organooxygen compound (CHEBI:36963) |
| IUPAC Name |
|---|
| (3R,4S,5S,6S,9S)-1'-[(E)-3-hydroperoxy-3-methylbut-1-enyl]-3,4-dihydroxy-6'-methoxy-6-(2-methylprop-1-enyl)spiro[1,7-diazatricyclo[7.3.0.03,7]dodecane-5,3'-indole]-2,2',8-trione |
| Manual Xrefs | Databases |
|---|---|
| 27023457 | ChemSpider |