EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C39H43ClN4O9S2 |
| Net Charge | 0 |
| Average Mass | 811.379 |
| Monoisotopic Mass | 810.21600 |
| SMILES | COc1cc(NC(=O)OCCN(C)[C@H]2CC[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)CC2)c(Cl)cc1CNC[C@H](O)c1ccc(O)c2nc(=O)ccc12 |
| InChI | InChI=1S/C39H43ClN4O9S2/c1-44(24-7-9-25(10-8-24)53-37(48)39(50,33-5-3-17-54-33)34-6-4-18-55-34)15-16-52-38(49)42-29-20-32(51-2)23(19-28(29)40)21-41-22-31(46)26-11-13-30(45)36-27(26)12-14-35(47)43-36/h3-6,11-14,17-20,24-25,31,41,45-46,50H,7-10,15-16,21-22H2,1-2H3,(H,42,49)(H,43,47)/t24-,25-,31-/m0/s1 |
| InChIKey | SNXJYSXRLKUBSZ-WBXFWKJNSA-N |
| Roles Classification |
|---|
| Application: | anti-asthmatic agent Any compound that has anti-asthmatic effects. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| las190792 (CHEBI:755982) has role anti-asthmatic agent (CHEBI:65023) |
| las190792 (CHEBI:755982) is a quinolines (CHEBI:26513) |
| Synonyms | Source |
|---|---|
| Azd 8999 | ChEMBL |
| Las190792 | ChEMBL |
| LAS-190792 | ChEMBL |
| Citations |
|---|