5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,7-[[(2Z)-(2-amino-4-thiazolyl)[(carboxymethoxy)imino]acetyl]amino]-3-ethenyl-8-oxo-, trihydrate, (6R,7R)-


Chemical Name: 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,7-[[(2Z)-(2-amino-4-thiazolyl)[(carboxymethoxy)imino]acetyl]amino]-3-ethenyl-8-oxo-, trihydrate, (6R,7R)-
CAS Number: 125110-14-7
Product Number: AG007432(AGN-PC-0PHYUI)
Synonyms:
MDL No:
Molecular Formula: C16H15N5O7S2
Molecular Weight: 453.4496

Identification/Properties


Computed Properties
Molecular Weight:
507.489g/mol
Hydrogen Bond Donor Count:
7
Hydrogen Bond Acceptor Count:
15
Rotatable Bond Count:
8
Exact Mass:
507.073g/mol
Monoisotopic Mass:
507.073g/mol
Topological Polar Surface Area:
241A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
861
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
4
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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