Potassium (6R,7R)-3-acetoxymethyl-7-(D-5-amino-5-carboxypentanamido)-ceph-3-em-4-carboxylic acid

Base Information

• Chemical Name: Potassium (6R,7R)-3-acetoxymethyl-7-(D-5-amino-5-carboxypentanamido)-ceph-3-em-4-carboxylic acid
• CAS No.: 26944-38-7
• Molecular Formula: C16H19K2N3O8S
• Molecular Weight: 491.59896
• European Community (EC) Number: 260-987-0,248-123-0
• Mol file: 26944-38-7.mol

Synonyms:26944-38-7;EINECS 248-123-0;(6R-(6alpha,7beta(S*)))-3-(Acetoxymethyl)-7-(5-amino-5-carboxyvalerylamino)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, potassium salt;57847-70-8;EINECS 260-987-0;Potassium (6R,7R)-3-acetoxymethyl-7-(D-5-amino-5-carboxypentanamido)-ceph-3-em-4-carboxylic acid;C16H21N3O8S.xK;C16-H21-N3-O8-S.x-K;(6R-(6alpha,7beta(R*)))-3-(Acetoxymethyl)-7-((5-amino-5-carboxypentanoyl)amino)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, potassium salt;[6R-[6alpha,7beta(R*)]]-3-(acetoxymethyl)-7-[(5-amino-5-carboxypentanoyl)amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, potassium salt;[6R-[6alpha,7beta(S*)]]-3-(acetoxymethyl)-7-(5-amino-5-carboxyvalerylamino)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, potassium salt;5-Thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic acid, 3-((acetyloxy)methyl)-7-((5-amino-5-carboxy-1-oxopentyl)amino)-8-oxo-, potassium salt, (6R-(6alpha,7beta(R*)))-

Chemical Property of Potassium (6R,7R)-3-acetoxymethyl-7-(D-5-amino-5-carboxypentanamido)-ceph-3-em-4-carboxylic acid

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 8
• Exact Mass: 491.0166987
• Heavy Atom Count: 30
• Complexity: 726

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OCC1=C(N2C(C(C2=O)NC(=O)CCCC(C(=O)[O-])N)SC1)C(=O)[O-].[K+].[K+]
• Isomeric SMILES: CC(=O)OCC1=C(N2[C@@H]([C@@H](C2=O)NC(=O)CCCC(C(=O)[O-])N)SC1)C(=O)[O-].[K+].[K+]