EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | O4S.H2O.C30H35ClN7O10S2.C30H35ClN7O10S2.C30H35ClN7O10S2.C7H8O3S.C7H8O3S.C7H8O3S.C7H7O3S |
| Net Charge | 0 |
| Average Mass | 3061.598 |
| Monoisotopic Mass | 3057.50473 |
| SMILES | Cc1ccc(S(=O)(=O)O)cc1.Cc1ccc(S(=O)(=O)O)cc1.Cc1ccc(S(=O)(=O)O)cc1.Cc1ccc(S(=O)(=O)[O-])cc1.O.O=S(=O)([O-])[O-].[H][C@]12SCC(C[N+]3(CCNC(=O)c4ccc(O)c(O)c4Cl)CCCC3)=C(C(=O)O)N1C(=O)[C@H]2NC(=O)/C(=N\OC(C)(C)C(=O)O)c1csc(N)n1.[H][C@]12SCC(C[N+]3(CCNC(=O)c4ccc(O)c(O)c4Cl)CCCC3)=C(C(=O)O)N1C(=O)[C@H]2NC(=O)/C(=N\OC(C)(C)C(=O)O)c1csc(N)n1.[H][C@]12SCC(C[N+]3(CCNC(=O)c4ccc(O)c(O)c4Cl)CCCC3)=C(C(=O)O)N1C(=O)[C@H]2NC(=O)/C(=N\OC(C)(C)C(=O)O)c1csc(N)n1 |
| InChI | InChI=1S/3C30H34ClN7O10S2.4C7H8O3S.H2O4S.H2O/c3*1-30(2,28(46)47)48-36-19(16-13-50-29(32)34-16)24(42)35-20-25(43)37-21(27(44)45)14(12-49-26(20)37)11-38(8-3-4-9-38)10-7-33-23(41)15-5-6-17(39)22(40)18(15)31;4*1-6-2-4-7(5-3-6)11(8,9)10;1-5(2,3)4;/h3*5-6,13,20,26H,3-4,7-12H2,1-2H3,(H7-,32,33,34,35,36,39,40,41,42,44,45,46,47);4*2-5H,1H3,(H,8,9,10);(H2,1,2,3,4);1H2/t3*20-,26-;;;;;;/m111....../s1 |
| InChIKey | QNMVZYPDWLKAJC-RXVBEKIDSA-N |
| Roles Classification |
|---|
| Biological Role: | antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. |
| Application: | antiinfective agent A substance used in the prophylaxis or therapy of infectious diseases. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| cefiderocol sulfate tosylate (CHEBI:756718) has functional parent pentacarboxylic acid (CHEBI:35743) |
| cefiderocol sulfate tosylate (CHEBI:756718) has role antibacterial agent (CHEBI:33282) |
| cefiderocol sulfate tosylate (CHEBI:756718) has role antiinfective agent (CHEBI:35441) |
| cefiderocol sulfate tosylate (CHEBI:756718) is a organooxygen compound (CHEBI:36963) |
| Synonyms | Source |
|---|---|
| Cefiderocol sulfate tosilate | ChEMBL |
| Cefiderocol sulfate tosylate | ChEMBL |
| Cefiderocol tosilate sulfate hydrate | ChEMBL |
| GSK-2696266D | ChEMBL |
| GSK2696266D | ChEMBL |
| S-649266D | ChEMBL |
| Brand Names | Source |
|---|---|
| Fetcroja | ChEMBL |
| Fetroja | ChEMBL |