EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C4H4O4.C25H17F3N4O3.C25H17F3N4O3.C4H4O4.C4H4O4 |
| Net Charge | 0 |
| Average Mass | 1305.076 |
| Monoisotopic Mass | 1304.28343 |
| SMILES | O=C(O)/C=C/C(=O)O.O=C(O)/C=C/C(=O)O.O=C(O)/C=C/C(=O)O.[H][C@@]12c3cc(Oc4ccnc5c4CCC(=O)N5)ccc3O[C@]1([H])[C@H]2c1nc2ccc(C(F)(F)F)cc2n1.[H][C@@]12c3cc(Oc4ccnc5c4CCC(=O)N5)ccc3O[C@]1([H])[C@H]2c1nc2ccc(C(F)(F)F)cc2n1 |
| InChI | InChI=1S/2C25H17F3N4O3.3C4H4O4/c2*26-25(27,28)11-1-4-15-16(9-11)31-24(30-15)21-20-14-10-12(2-5-17(14)35-22(20)21)34-18-7-8-29-23-13(18)3-6-19(33)32-23;3*5-3(6)1-2-4(7)8/h2*1-2,4-5,7-10,20-22H,3,6H2,(H,30,31)(H,29,32,33);3*1-2H,(H,5,6)(H,7,8)/b;;3*2-1+/t2*20-,21-,22-;;;/m00.../s1 |
| InChIKey | CETNPISTLYWCDC-CSKNCWRTSA-N |
| Roles Classification |
|---|
| Application: | antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| lifirafenib maleate (CHEBI:757556) has functional parent pentacarboxylic acid (CHEBI:35743) |
| lifirafenib maleate (CHEBI:757556) has role antineoplastic agent (CHEBI:35610) |
| lifirafenib maleate (CHEBI:757556) is a organooxygen compound (CHEBI:36963) |
| Synonyms | Source |
|---|---|
| BGB-283 sesqui-maleate | ChEMBL |
| Lifirafenib maleate | ChEMBL |
| Lifirafenib sesquimaleate | ChEMBL |