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Cefpodoxime free acid

CAT: 0862-GA5004-250mgSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0862-GA5004-250mgSize:250 mg
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CAS Number
80210-62-4
MDL Number
MFCD00864906
HS Code
29419000
Purity
97.00%
Molecular Formula
C15H17N5O6S2
Molecular Weight
427.46
Storage Conditions
-20°C
Hazardous Class
Not hazardous

Chemical Information

Cefpodoxime

Cefpodoxime is a third-generation cephalosporin antibiotic with methoxymethyl and (2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetamino substituents at positions 3 and 7, respectively, of the cephem skeleton. Given by mouth as its proxetil ester prodrug, it is used to treat acute otitis media, pharyngitis, and sinusitis. It has a role as an antibacterial drug. It is a cephalosporin and a carboxylic acid.

CAS Number80210-62-4
PubChem CID6335986
IUPAC Name(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-(methoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Molecular FormulaC15H17N5O6S2
Molecular Weight427.5
XLogP-1.4
Topological Polar Surface Area210
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity744
SMILES
COCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)/C(=N\OC)/C3=CSC(=N3)N)SC1)C(=O)O
InChI
InChI=1S/C15H17N5O6S2/c1-25-3-6-4-27-13-9(12(22)20(13)10(6)14(23)24)18-11(21)8(19-26-2)7-5-28-15(16)17-7/h5,9,13H,3-4H2,1-2H3,(H2,16,17)(H,18,21)(H,23,24)/b19-8-/t9-,13-/m1/s1
InChIKey
WYUSVOMTXWRGEK-HBWVYFAYSA-N
Chemical Structure
2D Structure
2D structure of Cefpodoxime
CAS: 80210-62-4
CID: 6335986
Formula: C15H17N5O6S2
MW: 427.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight427.5
XLogP3-1.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count11
Rotatable Bond Count7
Exact Mass427.06202563
Monoisotopic Mass427.06202563
Topological Polar Surface Area210 Ų
Heavy Atom Count28
Formal Charge0
Complexity744
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes