EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C29H34ClN3O |
| Net Charge | 0 |
| Average Mass | 476.064 |
| Monoisotopic Mass | 475.23904 |
| SMILES | Cc1ccc(Cn2nc(C(=O)N[C@@H]3C(C)(C)[C@@H]4CC[C@]3(C)C4)cc2-c2ccc(Cl)c(C)c2)cc1 |
| InChI | InChI=1S/C29H34ClN3O/c1-18-6-8-20(9-7-18)17-33-25(21-10-11-23(30)19(2)14-21)15-24(32-33)26(34)31-27-28(3,4)22-12-13-29(27,5)16-22/h6-11,14-15,22,27H,12-13,16-17H2,1-5H3,(H,31,34)/t22-,27-,29-/m1/s1 |
| InChIKey | SUGVYNSRNKFXQM-SGNYCRIWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 5-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]-N-[(1R,3S,4R)-2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl]-3-pyrazolecarboxamide (CHEBI:125578) is a pyrazoles (CHEBI:26410) |
| 5-(4-chloro-3-methylphenyl)-1-[(4-methylphenyl)methyl]-N-[(1R,3S,4R)-2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl]-3-pyrazolecarboxamide (CHEBI:125578) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-37114 | LINCS |