Cefotiam Impurity | CAS No. 58684-56-3

Cefotiam Impurity

Basic Information

CAS Number

58684-56-3

Molecular Formula

C13H14N4O4S2

Molecular Weight

354.4 g/mol

AD

Basic Physical Properties

Boiling Point

825.3±65.0 °C(Predicted)

Density

1.66±0.1 g/cm3(Predicted)

CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)Cc3csc(N)n3)[C@H]2SC1

InChI

InChI=1S/C13H14N4O4S2/c1-5-3-22-11-8(10(19)17(11)9(5)12(20)21)16-7(18)2-6-4-23-13(14)15-6/h4,8,11H,2-3H2,1H3,(H2,14,15)(H,16,18)(H,20,21)/t8-,11-/m1/s1

InChIKey

WRGRCPZZJLWONI-LDYMZIIASA-N

pKa

3.12±0.50(Predicted)

Synonyms & References

English

  • Cefotiam Impurity
  • 2-(2-aminothiazol-4-yl)-N-((5aR,6R)-1,7-dioxo-1,3,4,5a,6,7-hexahydroazeto[2,1-b]furo[3,4-d][1,3]thiazin-6-yl)acetamide
  • Cefotiam lactone
  • (6R,7R)-7-(2-(2-aminothiazol-4-yl)acetamido)-3-(hydroxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
  • Cefotiam impurity 4/3-Methyl-Cefotiam/(6R,7R)-7-(2-(2-aminothiazol-4-yl)acetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(2-amino-4-thiazolyl)acetyl]amino]-3-methyl-8-oxo-, (6R-trans)- (9CI)
  • (6R,7R)-7-(2-(2-aminothiazol-4-yl)acetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
  • (6R,7R)-7-(2-(2-aminothiazol-4-yl)acetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-ca
  • Cefotiam 3- methyl Cefotiamine
  • (6R,7R)-7-(2-(2-Aminothiazol-4-yl)acetamido)-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

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