EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C22H21FN4O3S |
| Net Charge | 0 |
| Average Mass | 440.500 |
| Monoisotopic Mass | 440.13184 |
| SMILES | CN1[C@@H]2c3ccc(-c4cccc(F)c4)c(=O)n3C[C@H]1[C@H](CO)[C@H]2C(=O)Nc1nccs1 |
| InChI | InChI=1S/C22H21FN4O3S/c1-26-17-10-27-16(6-5-14(21(27)30)12-3-2-4-13(23)9-12)19(26)18(15(17)11-28)20(29)25-22-24-7-8-31-22/h2-9,15,17-19,28H,10-11H2,1H3,(H,24,25,29)/t15-,17-,18+,19+/m0/s1 |
| InChIKey | CVDFBNGMHHTSQY-GDAAHCPNSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-11029 (CHEBI:99650) is a phenylpyridine (CHEBI:38193) |
| Manual Xrefs | Databases |
|---|---|
| LSM-11029 | LINCS |