EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C26H21BrClN3O4 |
| Net Charge | 0 |
| Average Mass | 554.828 |
| Monoisotopic Mass | 553.04040 |
| SMILES | COc1ccccc1[C@@H]1C(c2cccc(Cl)c2)=NN(c2ccc(Br)cc2)[C@H]1C(=O)N1CCOC1=O |
| InChI | InChI=1S/C26H21BrClN3O4/c1-34-21-8-3-2-7-20(21)22-23(16-5-4-6-18(28)15-16)29-31(19-11-9-17(27)10-12-19)24(22)25(32)30-13-14-35-26(30)33/h2-12,15,22,24H,13-14H2,1H3/t22-,24-/m1/s1 |
| InChIKey | HUGQWZZOCRYXFK-ISKFKSNPSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-[[(3R,4S)-2-(4-bromophenyl)-5-(3-chlorophenyl)-4-(2-methoxyphenyl)-3,4-dihydropyrazol-3-yl]-oxomethyl]-2-oxazolidinone (CHEBI:117187) is a stilbenoid (CHEBI:26776) |
| Manual Xrefs | Databases |
|---|---|
| LSM-28636 | LINCS |