EMBL-EBI | Chemical Biology | ChEBI
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| Formula | H2O.C26H43O9.Ca.C26H43O9.H2O |
| Net Charge | 0 |
| Average Mass | 1075.350 |
| Monoisotopic Mass | 1074.56514 |
| SMILES | O.O.[Ca+2].[H][C@]1(C[C@@H]2O[C@@]2([H])[C@@H](C)[C@H](C)O)CO[C@@H](C/C(C)=C/C(=O)OCCCCCCCCC(=O)[O-])[C@H](O)[C@@H]1O.[H][C@]1(C[C@@H]2O[C@@]2([H])[C@@H](C)[C@H](C)O)CO[C@@H](C/C(C)=C/C(=O)OCCCCCCCCC(=O)[O-])[C@H](O)[C@@H]1O |
| InChI | InChI=1S/2C26H44O9.Ca.2H2O/c2*1-16(13-23(30)33-11-9-7-5-4-6-8-10-22(28)29)12-20-25(32)24(31)19(15-34-20)14-21-26(35-21)17(2)18(3)27;;;/h2*13,17-21,24-27,31-32H,4-12,14-15H2,1-3H3,(H,28,29);;2*1H2/q;;+2;;/p-2/b2*16-13+;;;/t2*17-,18-,19-,20-,21-,24+,25-,26-;;;/m00.../s1 |
| InChIKey | DDHVILIIHBIMQU-YJGQQKNPSA-L |
| Roles Classification |
|---|
| Biological Role: | antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. |
| Applications: | vulnerary A drug used in treating and healing of wounds. antiinfective agent A substance used in the prophylaxis or therapy of infectious diseases. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| mupirocin calcium (CHEBI:756265) has functional parent tetracarboxylic acid (CHEBI:35742) |
| mupirocin calcium (CHEBI:756265) has role antibacterial agent (CHEBI:33282) |
| mupirocin calcium (CHEBI:756265) has role antiinfective agent (CHEBI:35441) |
| mupirocin calcium (CHEBI:756265) has role vulnerary (CHEBI:73336) |
| mupirocin calcium (CHEBI:756265) is a organooxygen compound (CHEBI:36963) |
| Synonyms | Source |
|---|---|
| Calcium mupirocin dihydrate | ChEMBL |
| Calcium pseudomonate | ChEMBL |