Mupirocin Calcium
calcium;bis(9-[(E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]oxiran-2-yl]methyl]oxan-2-yl]-3-methylbut-2-enoyl]oxynonanoate);dihydrate
Molecular Identity
Mupirocin Calcium
calcium;bis(9-[(E)-4-[(2S,3R,4R,5S)-3,4-dihydroxy-5-[[(2S,3S)-3-[(2S,3S)-3-hydroxybutan-2-yl]oxiran-2-yl]methyl]oxan-2-yl]-3-methylbut-2-enoyl]oxynonanoate);dihydrate
PubChem CID: 5282317
Mupirocin calcium hydrate is a hydrate that is the dihydrate form of mupirocin calcium. It is an antibacterial drug used for the treatment of skin infections such as impetigo caused by Staphylococcus aureus and meticillin-resistant Staphylococcus aureus (MRSA). It has a role as an antiinfective agent, an antibacterial drug and a protein synthesis inhibitor. It contains a mupirocin calcium (anhydrous).
2D Structure
Properties
C52H90CaO20
Molecular Formula
1075.30
Molecular Weight
g/mol
1074.5651
Exact Mass
Da
300
TPSA
May have limited oral absorption
8
H-Bond Donors
20
H-Bond Acceptors
689
Complexity
SMILES
Canonical SMILES
SMILES: CC(C1C(O1)CC2COC(C(C2O)O)CC(=CC(=O)OCCCCCCCCC(=O)[O-])C)C(C)O.CC(C1C(O1)CC2COC(C(C2O)O)CC(=CC(=O)OCCCCCCCCC(=O)[O-])C)C(C)O.O.O.[Ca+2]Isomeric SMILES
SMILES: C[C@@H]([C@@H](O)C)[C@@H]1O[C@H]1C[C@@H]2[C@H]([C@H]([C@@H](OC2)C/C(=C/C(=O)OCCCCCCCCC(=O)[O-])/C)O)O.C[C@@H]([C@@H](O)C)[C@@H]1O[C@H]1C[C@@H]2[C@H]([C@H]([C@@H](OC2)C/C(=C/C(=O)OCCCCCCCCC(=O)[O-])/C)O)O.O.O.[Ca+2]Synonyms(20)
Mupirocin calciumMupirocin calcium dihydratemupirocin calcium hydrateBRL 4910FBRL-4910FRG38I2P540CHEBI:34858DTXSID90883142PirnuoRefChem:55673DTXCID301510752Monocalcium bis(9-((2E)-4-((2S,3R,4R,5S)-5-((2S,3S,4S,5S)-2,3-epoxy-5-hydroxy-4-methylhexyl)-3,4-dihydroxy-3,4,5,6-tetrahydro-2H-pyran-2-yl)-3-methylbut-2-enoyloxy)nonanoate) dihydrate115074-43-6BactrobanCalcium mupirocin dihydrate
Data from PubChem (NCBI)
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Trials and conditions connected to Mupirocin Calcium
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