EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C27H29ClFN9O4 |
| Net Charge | 0 |
| Average Mass | 598.039 |
| Monoisotopic Mass | 597.20151 |
| SMILES | CCOC(=O)O[C@@H](C)n1nnnc1-c1c(-c2ccc(C(=O)N(c3ncccc3Cl)[C@@H]3CCCNC3)cc2F)cnn1C |
| InChI | InChI=1S/C27H29ClFN9O4/c1-4-41-27(40)42-16(2)38-25(33-34-35-38)23-20(15-32-36(23)3)19-10-9-17(13-22(19)29)26(39)37(18-7-5-11-30-14-18)24-21(28)8-6-12-31-24/h6,8-10,12-13,15-16,18,30H,4-5,7,11,14H2,1-3H3/t16-,18+/m0/s1 |
| InChIKey | QTBYVAZRKWOIDU-FUHWJXTLSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| pf-06815345 (CHEBI:756650) is a pyrazoles (CHEBI:26410) |
| pf-06815345 (CHEBI:756650) is a ring assembly (CHEBI:36820) |
| Synonym | Source |
|---|---|
| PF-06815345 | ChEMBL |
| Citations |
|---|