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Clindamycin Phosphate

CAT: 0607-B1708-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0607-B1708-50Size:50 mg
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Description
Lincosamide antibiotic
CAS Number
24729-96-2
Product Name Alternative
[(2R,3R,4S,5R,6R)-6-[(1S,2S)-2-chloro-1-[[(2S,4R)-1-methyl-4-propylpyrrolidine-2-carbonyl]amino]propyl]-4,5-dihydroxy-2-methylsulfanyloxan-3-yl] dihydrogen phosphate
Field of Research
Lab Reagents Antibiotics
Purity
0.9803
Form
A solid
Solubility
≥21.7 mg/mL in H2O; insoluble in EtOH; insoluble in DMSO
Smiles
CCCC1CC(N(C1)C)C(=O)NC(C2C(C(C(C(O2)SC)OP(=O)(O)O)O)O)C(C)Cl
Molecular Formula
C18H34ClN2O8PS
Molecular Weight
504.96
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

Clindamycin Phosphate

Clindamycin Phosphate is the phosphate salt form of clindamycin, a semi-synthetic, chlorinated broad spectrum antibiotic produced by chemical modification of lincomycin. Clindamycin phosphate is used in topical preparations.

CAS Number24729-96-2
PubChem CID443385
IUPAC Name[(2R,3R,4S,5R,6R)-6-[(1S,2S)-2-chloro-1-[[(2S,4R)-1-methyl-4-propylpyrrolidine-2-carbonyl]amino]propyl]-4,5-dihydroxy-2-methylsulfanyloxan-3-yl] dihydrogen phosphate
Molecular FormulaC18H34ClN2O8PS
Molecular Weight505.0
XLogP-1.2
Topological Polar Surface Area174
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Heavy Atom Count31
Formal Charge0
Complexity658
SMILES
CCC[C@@H]1C[C@H](N(C1)C)C(=O)N[C@@H]([C@@H]2[C@@H]([C@@H]([C@H]([C@H](O2)SC)OP(=O)(O)O)O)O)[C@H](C)Cl
InChI
InChI=1S/C18H34ClN2O8PS/c1-5-6-10-7-11(21(3)8-10)17(24)20-12(9(2)19)15-13(22)14(23)16(18(28-15)31-4)29-30(25,26)27/h9-16,18,22-23H,5-8H2,1-4H3,(H,20,24)(H2,25,26,27)/t9-,10+,11-,12+,13+,14-,15+,16+,18+/m0/s1
InChIKey
UFUVLHLTWXBHGZ-MGZQPHGTSA-N
Chemical Structure
2D Structure
2D structure of Clindamycin Phosphate
CAS: 24729-96-2
CID: 443385
Formula: C18H34ClN2O8PS
MW: 505.0
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight505.0
XLogP3-1.2
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count10
Rotatable Bond Count9
Exact Mass504.1462019
Monoisotopic Mass504.1462019
Topological Polar Surface Area174 Ų
Heavy Atom Count31
Formal Charge0
Complexity658
Isotope Atom Count0
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
40000058-4Clindamycin Phosphate
AM20485-01Clindamycin-2-phosphate
257243-01Clindamycin 2-phosphate
444867-01Clindamycin Phosphate Sulfone

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