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CHEBI:221951 - Porritoxin sulfonic acid
| Formula | C17H23NO6S |
| Net Charge | 0 |
| Average Mass | 369.439 |
| Monoisotopic Mass | 369.12461 |
| SMILES | COc1c(C)c(OCC=C(C)C)cc2c1CN(CCS(=O)(=O)O)C2=O |
| InChI | InChI=1S/C17H23NO6S/c1-11(2)5-7-24-15-9-13-14(16(23-4)12(15)3)10-18(17(13)19)6-8-25(20,21)22/h5,9H,6-8,10H2,1-4H3,(H,20,21,22) |
| InChIKey | MESAXYIANMGTSI-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Alternaria porri (ncbitaxon:48098) | - | PubMed (12913305) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Porritoxin sulfonic acid (CHEBI:221951) is a isoindoles (CHEBI:24897) |
| IUPAC Name |
|---|
| 2-[7-methoxy-6-methyl-5-(3-methylbut-2-enoxy)-3-oxo-1H-isoindol-2-yl]ethanesulonic acid |
| Manual Xrefs | Databases |
|---|---|
| 78435036 | ChemSpider |