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Cefotaxime Sodium Salt

CAT: 1596-AR-C01903-01Size: 50 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-C01903-01Size:50 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
64485-93-4
Synonyms
(6R,7R) -3- (acetoxymethyl) -7- ((Z) -2- (2-aminothiazol-4-yl) -2- (methoxyimino) acetamido) -8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, sodium salt; Cefotax; HR 756; Pretor; Tolycar; Cefotaxime Sodium; Ralopar; Sodium 7- (2- (2-amino-4-thiazolyl) -2-methoxyiminoacetamido) cephalosporanate; sodium 3- (acetoxymethyl) -7beta-{[ (2Z) -2- (2-amino-1,3-thiazol-4-yl) -2- (methoxyimino) acetyl]amino}-3,4-didehydrocepham-4-carboxylate
Molecular Formula
C16H16N5O7S2. Na
Molecular Weight
454.46 22.99
API Name
Cefotaxime

Chemical Information

Cefotaxime Sodium

Cefotaxime sodium is a cephalosporin organic sodium salt having acetoxymethyl and [2-(2-amino-1,3-thiazol-4-yl)-2-(methoxyimino)acetyl]amino side-groups. It contains a cefotaxime(1-).

CAS Number64485-93-4
PubChem CID10695961
IUPAC Namesodium (6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Molecular FormulaC16H16N5NaO7S2
Molecular Weight477.5
Topological Polar Surface Area230
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count12
Rotatable Bond Count8
Heavy Atom Count31
Formal Charge0
Complexity839
SMILES
CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)/C(=N\OC)/C3=CSC(=N3)N)SC1)C(=O)[O-].[Na+]
InChI
InChI=1S/C16H17N5O7S2.Na/c1-6(22)28-3-7-4-29-14-10(13(24)21(14)11(7)15(25)26)19-12(23)9(20-27-2)8-5-30-16(17)18-8;/h5,10,14H,3-4H2,1-2H3,(H2,17,18)(H,19,23)(H,25,26);/q;+1/p-1/b20-9-;/t10-,14-;/m1./s1
InChIKey
AZZMGZXNTDTSME-JUZDKLSSSA-M
Chemical Structure
2D Structure
2D structure of Cefotaxime Sodium
CAS: 64485-93-4
CID: 10695961
Formula: C16H16N5NaO7S2
MW: 477.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight477.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count12
Rotatable Bond Count8
Exact Mass477.03888450
Monoisotopic Mass477.03888450
Topological Polar Surface Area230 Ų
Heavy Atom Count31
Formal Charge0
Complexity839
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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