EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H16F3N7O |
| Net Charge | 0 |
| Average Mass | 379.346 |
| Monoisotopic Mass | 379.13684 |
| SMILES | N#Cc1cnc(Nc2cc(NC[C@H]3CNCCO3)c(C(F)(F)F)cn2)cn1 |
| InChI | InChI=1S/C16H16F3N7O/c17-16(18,19)12-8-25-14(26-15-9-22-10(4-20)5-24-15)3-13(12)23-7-11-6-21-1-2-27-11/h3,5,8-9,11,21H,1-2,6-7H2,(H2,23,24,25,26)/t11-/m1/s1 |
| InChIKey | YBYYWUUUGCNAHQ-LLVKDONJSA-N |
| Roles Classification |
|---|
| Application: | antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| sra-737 (CHEBI:756624) has role antineoplastic agent (CHEBI:35610) |
| sra-737 (CHEBI:756624) is a chloropyridine (CHEBI:39173) |
| Synonyms | Source |
|---|---|
| CCT-245737 | ChEMBL |
| CCT245737 | ChEMBL |
| CCT245737 FREE BASE | ChEMBL |
| PNT-737 | ChEMBL |
| PNT737 | ChEMBL |
| Sra 737 | ChEMBL |
| Citations |
|---|