Mupirocin calcium salt

CAT: 0862-GA7711-100mgSize: 100 mgDry Ice: NoHazardous: No

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CAT#:0862-GA7711-100mgSize:100 mg

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CAS Number

115074-43-6

HS Code

29419000

Purity

865.00μg/mg

Molecular Formula

C52H86CaO18 · xH2O

Molecular Weight

1039.30 (anhydrous)

Storage Conditions

+20°C

Hazardous Class

Not hazardous

Chemical Information

Mupirocin Calcium

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).

CAS Number	115074-43-6
PubChem CID	5282317
IUPAC Name	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 Formula	C52H90CaO20
Molecular Weight	1075.3
Topological Polar Surface Area	300
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	20
Rotatable Bond Count	32
Heavy Atom Count	73
Formal Charge	0
Complexity	689

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]

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

Chemical Structure

2D Structure

CAS: 115074-43-6

CID: 5282317

Formula: C52H90CaO20

MW: 1075.3

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	1075.3
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	20
Rotatable Bond Count	32
Exact Mass	1074.5651361
Monoisotopic Mass	1074.5651361
Topological Polar Surface Area	300 Å²
Heavy Atom Count	73
Formal Charge	0
Complexity	689
Isotope Atom Count	0
Defined Atom Stereocenter Count	16
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	5
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
sc-477645A	Mupirocin Calcium Salt
C6500-50	Mupirocin calcium
HY-B0958A	Mupirocin (calcium)
HY-N7068-01	Mupirocin (calcium hydrate)
GTR19167266-01	Mupirocin calcium hydrate
M023-100MG	Mupirocin lithium salt
574479	Mupirocin calcium dihydrate

Mupirocin calcium salt

Chemical Information

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