disodium;(7R)-7-[[(2R)-2-hydroxy-2-phenylacetyl]amino]-8-oxo-3-[[1-(sulfonatomethyl)tetrazol-5-yl]sulfanylmethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate


Chemical Name: disodium;(7R)-7-[[(2R)-2-hydroxy-2-phenylacetyl]amino]-8-oxo-3-[[1-(sulfonatomethyl)tetrazol-5-yl]sulfanylmethyl]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
CAS Number: 61270-78-8
Product Number: AG00JKJ6(AGN-PC-006GTU)
Synonyms:
MDL No: MFCD00941437
Molecular Formula: C18H16N6Na2O8S3
Molecular Weight: 586.5296

Identification/Properties


Computed Properties
Molecular Weight:
586.52g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
13
Rotatable Bond Count:
7
Exact Mass:
585.999g/mol
Monoisotopic Mass:
585.999g/mol
Topological Polar Surface Area:
270A^2
Heavy Atom Count:
37
Formal Charge:
0
Complexity:
980
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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