EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H23F2N5O2 |
| Net Charge | 0 |
| Average Mass | 451.477 |
| Monoisotopic Mass | 451.18198 |
| SMILES | COc1ccc(-c2c(-c3ccc(C#N)c(F)c3)nc(N3CCC(N)CC3)n(C)c2=O)cc1F |
| InChI | InChI=1S/C24H23F2N5O2/c1-30-23(32)21(14-5-6-20(33-2)19(26)11-14)22(15-3-4-16(13-27)18(25)12-15)29-24(30)31-9-7-17(28)8-10-31/h3-6,11-12,17H,7-10,28H2,1-2H3 |
| InChIKey | NBAIXBAUHIQQGF-UHFFFAOYSA-N |
| ChEBI Ontology |
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| Outgoing Relation(s) |
| pulrodemstat (CHEBI:758417) is a methoxybenzenes (CHEBI:51683) |
| Citations |
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