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CHEBI:752567 - cevipabulin succinate
| Formula | H2O.C18H18ClF5N6O.C4H6O4.H2O |
| Net Charge | 0 |
| Average Mass | 618.944 |
| Monoisotopic Mass | 618.16282 |
| SMILES | CNCCCOc1cc(F)c(-c2c(Cl)nc3ncnn3c2N[C@@H](C)C(F)(F)F)c(F)c1.O.O.O=C(O)CCC(=O)O |
| InChI | InChI=1S/C18H18ClF5N6O.C4H6O4.2H2O/c1-9(18(22,23)24)28-16-14(15(19)29-17-26-8-27-30(16)17)13-11(20)6-10(7-12(13)21)31-5-3-4-25-2;5-3(6)1-2-4(7)8;;/h6-9,25,28H,3-5H2,1-2H3;1-2H2,(H,5,6)(H,7,8);2*1H2/t9-;;;/m0.../s1 |
| InChIKey | FWNIBMRSBSSPNP-DXYFNVQQSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| cevipabulin succinate (CHEBI:752567) is a triazolopyrimidines (CHEBI:48435) |
| Synonyms | Source |
|---|---|
| Cevipabulin succinate | ChEMBL |
| TTI-237 SUCCINATE DIHYDRATE | ChEMBL |