EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C24H30Cl2FN3O4 |
| Net Charge | 0 |
| Average Mass | 514.425 |
| Monoisotopic Mass | 513.15974 |
| SMILES | CO[C@H](CN(C)C(=O)c1cc(Cl)cc(Cl)c1)[C@H](C)CN(C(=O)Nc1ccc(F)cc1)[C@@H](C)CO |
| InChI | InChI=1S/C24H30Cl2FN3O4/c1-15(12-30(16(2)14-31)24(33)28-21-7-5-20(27)6-8-21)22(34-4)13-29(3)23(32)17-9-18(25)11-19(26)10-17/h5-11,15-16,22,31H,12-14H2,1-4H3,(H,28,33)/t15-,16+,22-/m1/s1 |
| InChIKey | IBBRHRMMLVXSHB-ZMPRRUGASA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3,5-dichloro-N-[(2S,3R)-4-[[(4-fluoroanilino)-oxomethyl]-[(2S)-1-hydroxypropan-2-yl]amino]-2-methoxy-3-methylbutyl]-N-methylbenzamide (CHEBI:100725) is a ureas (CHEBI:47857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-12099 | LINCS |