EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C24H28ClN5O3 |
| Net Charge | 0 |
| Average Mass | 469.973 |
| Monoisotopic Mass | 469.18807 |
| SMILES | O=C(Nc1cccc(Cl)c1)N[C@@H]1CC[C@H](CCn2cc(Cc3ccccc3)nn2)O[C@H]1CO |
| InChI | InChI=1S/C24H28ClN5O3/c25-18-7-4-8-19(14-18)26-24(32)27-22-10-9-21(33-23(22)16-31)11-12-30-15-20(28-29-30)13-17-5-2-1-3-6-17/h1-8,14-15,21-23,31H,9-13,16H2,(H2,26,27,32)/t21-,22-,23+/m1/s1 |
| InChIKey | QIJBHKKZJCMHEO-ZLNRFVROSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(2R,3R,6R)-6-[2-(4-benzyltriazol-1-yl)ethyl]-2-(hydroxymethyl)oxan-3-yl]-3-(3-chlorophenyl)urea (CHEBI:97287) is a C-glycosyl compound (CHEBI:20857) |
| Manual Xrefs | Databases |
|---|---|
| LSM-8666 | LINCS |