EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C32H30F2N4O4 |
| Net Charge | 0 |
| Average Mass | 572.612 |
| Monoisotopic Mass | 572.22351 |
| SMILES | Cc1c(-c2c(F)cc(C(N)=O)c3nc4c(c23)CC[C@H](C(C)(C)O)C4)cccc1-n1c(=O)c2cccc(F)c2n(C)c1=O |
| InChI | InChI=1S/C32H30F2N4O4/c1-15-17(7-6-10-24(15)38-30(40)19-8-5-9-21(33)28(19)37(4)31(38)41)25-22(34)14-20(29(35)39)27-26(25)18-12-11-16(32(2,3)42)13-23(18)36-27/h5-10,14,16,36,42H,11-13H2,1-4H3,(H2,35,39)/t16-/m0/s1 |
| InChIKey | ZRYMMWAJAFUANM-INIZCTEOSA-N |
| Roles Classification |
|---|
| Application: | antirheumatic drug A drug used to treat rheumatoid arthritis. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| bms-986142 (CHEBI:755969) has role antirheumatic drug (CHEBI:35842) |
| bms-986142 (CHEBI:755969) is a carbazoles (CHEBI:48513) |
| Synonym | Source |
|---|---|
| Bms-986142 | ChEMBL |
| Citations |
|---|