EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H22CuN4O8S |
| Net Charge | 0 |
| Average Mass | 554.040 |
| Monoisotopic Mass | 553.04543 |
| SMILES | [H]c1c([H])c(C(=O)N([H])C([H])([H])C([H])([H])c2c([H])c([H])c(S(=O)(=O)N([H])[H])c([H])c2[H])c([H])c(N([H])C(=O)C([H])([H])N2C([H])([H])C(=O)[O][Cu][O]C(=O)C2([H])[H])c1[H] |
| InChI | InChI=1S/C21H24N4O8S.Cu/c22-34(32,33)17-6-4-14(5-7-17)8-9-23-21(31)15-2-1-3-16(10-15)24-18(26)11-25(12-19(27)28)13-20(29)30;/h1-7,10H,8-9,11-13H2,(H,23,31)(H,24,26)(H,27,28)(H,29,30)(H2,22,32,33);/q;+2/p-2 |
| InChIKey | BFNCODDGGUDYNJ-UHFFFAOYSA-L |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [2,2'-{[2-({3-[({2-[4-(AMINOSULFONYL)PHENYL]ETHYL}AMINO)CARBONYL]PHENYL}AMINO)-2-OXOETHYL]IMINO}DIACETATO(2-)-KAPPAO]COPPER (CHEBI:47225) is a unclassifieds (CHEBI:27189) |
| Synonyms | Source |
|---|---|
| [2,2'-{[2-({3-[({2-[4-(AMINOSULFONYL)PHENYL]ETHYL}AMINO)CARBONYL]PHENYL}AMINO)-2-OXOETHYL]IMINO}DIACETATO(2-)-KAPPAO]COPPER | PDBeChem |
| [2,2'-({2-oxo-2-[(3-{[2-(4-sulfamoylphenyl)ethyl]carbamoyl}phenyl)amino]ethyl}imino)diacetato(2-)-kappaO]copper | PDBeChem |
| Manual Xrefs | Databases |
|---|---|
| B22 | PDBeChem |