Metampicillin

Base Information

• Chemical Name: Metampicillin
• CAS No.: 6489-97-0
• Deprecated CAS: 22232-69-5
• Molecular Formula: C17H19 N3 O4 S
• Molecular Weight: 383.39
• European Community (EC) Number: 229-365-6
• UNII: G0H6U7VSTK
• DSSTox Substance ID: DTXSID5048479
• Nikkaji Number: J9.598B
• Wikipedia: Metampicillin
• Wikidata: Q6584200
• NCI Thesaurus Code: C87368
• Metabolomics Workbench ID: 58063
• ChEMBL ID: CHEMBL1908324
• Mol file: 6489-97-0.mol

Synonyms:6-(2-methyleneamino-2-phenylacetamido)penicillanic acid;Magnipen;Metakes;metampicillin;metampicillin sodium;methampicillin;methampicillin, calcium salt (2:1), (2S-(2alpha,5alpha,6beta(S*)))-isomer;methampicillin, monosodium salt, (2S-(2alpha,5alpha,6beta(S*)))-isomer;methampicillin, sodium salt;Serfabiotic;Suvipen

Chemical Property of Metampicillin

Chemical Property:

• PKA: 2.44±0.50(Predicted)
• PSA: 124.37000
• Density: 1.46g/cm³
• LogP: 1.38880
• XLogP3: 3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 361.10962727
• Heavy Atom Count: 25
• Complexity: 603

Purity/Quality:

99% ^*data from raw suppliers

METAMPICILLIN 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)N=C)C(=O)O)C
• Isomeric SMILES: CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)[C@@H](C3=CC=CC=C3)N=C)C(=O)O)C
• Recent ClinicalTrials: Microbiome Metabolites and Alcohol in HIV to Reduce CVD RCT
• Therapeutic Function: Antibacterial

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