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CHEBI:201007 - Boletopsin 13
| Formula | C22H13Br3O9 |
| Net Charge | 0 |
| Average Mass | 661.049 |
| Monoisotopic Mass | 657.81097 |
| SMILES | CC(=O)Oc1c(-c2ccc(O)c(Br)c2)c(O)c2oc3c(Br)c(O)c(O)c(Br)c3c2c1OC(C)=O |
| InChI | InChI=1S/C22H13Br3O9/c1-6(26)32-21-11(8-3-4-10(28)9(23)5-8)16(29)20-13(22(21)33-7(2)27)12-14(24)17(30)18(31)15(25)19(12)34-20/h3-5,28-31H,1-2H3 |
| InChIKey | NTASHVRQISLMDV-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Boletopsisspecies (ncbitaxon:2012190) | - | PubMed (26207999) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Boletopsin 13 (CHEBI:201007) is a dibenzofurans (CHEBI:38922) |
| Boletopsin 13 (CHEBI:201007) is a organobromine compound (CHEBI:37141) |
| IUPAC Name |
|---|
| [1-acetyloxy-6,9-dibromo-3-(3-bromo-4-hydroxyphenyl)-4,7,8-trihydroxydibenzouran-2-yl] acetate |
| Manual Xrefs | Databases |
|---|---|
| 78435431 | ChemSpider |