EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H33NO5 |
| Net Charge | 0 |
| Average Mass | 427.541 |
| Monoisotopic Mass | 427.23587 |
| SMILES | C[C@H](O)C(=O)[C@@H](C)C/C=C/[C@H]1[C@@H]2O[C@]2(C)[C@@H](C)[C@H]2[C@H](Cc3ccccc3)NC(=O)[C@]21O |
| InChI | InChI=1S/C25H33NO5/c1-14(21(28)16(3)27)9-8-12-18-22-24(4,31-22)15(2)20-19(26-23(29)25(18,20)30)13-17-10-6-5-7-11-17/h5-8,10-12,14-16,18-20,22,27,30H,9,13H2,1-4H3,(H,26,29)/b12-8+/t14-,15-,16-,18-,19-,20-,22-,24+,25+/m0/s1 |
| InChIKey | NBVORADFJOAZAV-HFUIFYSESA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Aspergillus flavipes (ncbitaxon:41900) | - | DOI (10.1002/hlca.200800455) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cytochalasin Z20 (CHEBI:207641) is a isoindoles (CHEBI:24897) |
| IUPAC Name |
|---|
| (1aS,2S,2aS,5S,5aS,6S,6aR)-5-benzyl-2a-hydroxy-2-[(E,4S,6S)-6-hydroxy-4-methyl-5-oxohept-1-enyl]-6,6a-dimethyl-1a,2,4,5,5a,6-hexahydrooxireno[2,3-]isoindol-3-one |
| Manual Xrefs | Databases |
|---|---|
| 78441279 | ChemSpider |