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Cefquinome sulfate

CAS No.:
118443-89-3
Catalog Number:
AG000ITV
Molecular Formula:
C23H26N6O9S3
Molecular Weight:
626.6823
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
98%(HPLC)powder
In Stock USA
United States
$73
- +
25mg
98%(HPLC)powder
In Stock USA
United States
$128
- +
100mg
98%(HPLC)powder
In Stock USA
United States
$210
- +
250mg
98%(HPLC)powder
In Stock USA
United States
$429
- +
Product Description
Catalog Number:
AG000ITV
Chemical Name:
Cefquinome sulfate
CAS Number:
118443-89-3
Molecular Formula:
C23H26N6O9S3
Molecular Weight:
626.6823
MDL Number:
MFCD11864966
IUPAC Name:
(6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-8-oxo-3-(5,6,7,8-tetrahydroquinolin-1-ium-1-ylmethyl)-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid;hydrogen sulfate
InChI:
InChI=1S/C23H24N6O5S2.H2O4S/c1-34-27-16(14-11-36-23(24)25-14)19(30)26-17-20(31)29-18(22(32)33)13(10-35-21(17)29)9-28-8-4-6-12-5-2-3-7-15(12)28;1-5(2,3)4/h4,6,8,11,17,21H,2-3,5,7,9-10H2,1H3,(H3-,24,25,26,30,32,33);(H2,1,2,3,4)/b27-16-;/t17-,21-;/m1./s1
InChI Key:
KYOHRXSGUROPGY-OFNLCGNNSA-N
SMILES:
[O-]S(=O)(=O)O.CO/N=C(/c1csc(n1)N)\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)C[n+]1cccc2c1CCCC2
Properties
Complexity:
1050  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
1  
Exact Mass:
626.092g/mol
Formal Charge:
0
Heavy Atom Count:
41  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
626.674g/mol
Monoisotopic Mass:
626.092g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
290A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties