5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,7-[[(2Z)-(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-3-[[[5-(carboxymethyl)-4-methyl-2-thiazolyl]thio]methyl]-8-oxo-, disodium salt,(6R,7R)-


Chemical Name: 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,7-[[(2Z)-(2-amino-4-thiazolyl)(methoxyimino)acetyl]amino]-3-[[[5-(carboxymethyl)-4-methyl-2-thiazolyl]thio]methyl]-8-oxo-, disodium salt,(6R,7R)-
CAS Number: 86329-79-5
Product Number: AG008ERV(AGN-PC-0V45LP)
Synonyms:
MDL No: MFCD00897059
Molecular Formula: C20H18N6Na2O7S4
Molecular Weight: 628.6325

Identification/Properties


Computed Properties
Molecular Weight:
628.619g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
15
Rotatable Bond Count:
8
Exact Mass:
627.992g/mol
Monoisotopic Mass:
627.992g/mol
Topological Polar Surface Area:
310A^2
Heavy Atom Count:
39
Formal Charge:
0
Complexity:
1020
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:
3
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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