7-Aminodeacetoxycephalosporanic acid

CAS Registry Number®

22252-43-3

CAS Name

7-Aminodeacetoxycephalosporanic acid

Molecular Formula

C8H10N2O3S

Molecular Mass

214.24

Cite this Page

7-Aminodeacetoxycephalosporanic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22252-43-3 (retrieved 2024-11-24) (CAS RN: 22252-43-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    228-231 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H10N2O3S/c1-3-2-14-7-4(9)6(11)10(7)5(3)8(12)13/h4,7H,2,9H2,1H3,(H,12,13)/t4-,7-/m1/s1

InChIKey

InChIKey=NVIAYEIXYQCDAN-CLZZGJSISA-N

SMILES

C(O)(=O)C=1N2[C@@]([C@H](N)C2=O)(SCC1C)[H]

Canonical SMILES

O=C(O)C1=C(C)CSC2N1C(=O)C2N

Other Names for this Substance

  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-amino-3-methyl-8-oxo-, (6R,7R)-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-amino-3-methyl-8-oxo-
  • 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-amino-3-methyl-8-oxo-, (6R-trans)-
  • (6R,7R)-7-Amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
  • 7-Amino-3-methyl-3-cephem-4-carboxylic acid

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