EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C24H27F3N4O4 |
| Net Charge | 0 |
| Average Mass | 492.498 |
| Monoisotopic Mass | 492.19844 |
| SMILES | O=C([C@H]1[C@H](CO)[C@H]2Cn3c(ccc(-c4cccnc4)c3=O)[C@H]2N1CCC(F)(F)F)N1CCOCC1 |
| InChI | InChI=1S/C24H27F3N4O4/c25-24(26,27)5-7-30-20-17(18(14-32)21(30)23(34)29-8-10-35-11-9-29)13-31-19(20)4-3-16(22(31)33)15-2-1-6-28-12-15/h1-4,6,12,17-18,20-21,32H,5,7-11,13-14H2/t17-,18-,20+,21-/m1/s1 |
| InChIKey | FOQMOMHPOVABOQ-RMVXJAJNSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (2R,3R,3aS,9bS)-3-(hydroxymethyl)-2-(morpholine-4-carbonyl)-7-pyridin-3-yl-1-(3,3,3-trifluoropropyl)-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizin-6-one (CHEBI:97964) is a bipyridines (CHEBI:50511) |
| Manual Xrefs | Databases |
|---|---|
| LSM-9343 | LINCS |