EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H18BrNO3 |
| Net Charge | 0 |
| Average Mass | 376.250 |
| Monoisotopic Mass | 375.04701 |
| SMILES | Oc1cc2c(cc1C(c1ccc(Br)cc1)N1CCCC1)OCO2 |
| InChI | InChI=1S/C18H18BrNO3/c19-13-5-3-12(4-6-13)18(20-7-1-2-8-20)14-9-16-17(10-15(14)21)23-11-22-16/h3-6,9-10,18,21H,1-2,7-8,11H2 |
| InChIKey | CNHAVYWPOCSGHE-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-[(4-bromophenyl)-(1-pyrrolidinyl)methyl]-1,3-benzodioxol-5-ol (CHEBI:105661) is a benzodioxoles (CHEBI:38298) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17024 | LINCS |