Carumonam sodium

Base Information

• Chemical Name: Carumonam sodium
• CAS No.: 86832-68-0
• Molecular Formula: C12H14 N6 O10 S2 . 2 Na
• Molecular Weight: 510.371
• European Community (EC) Number: 623-165-6
• UNII: B4J4M4939D
• DSSTox Substance ID: DTXSID1046712
• NCI Thesaurus Code: C79905
• ChEMBL ID: CHEMBL2104060
• Mol file: 86832-68-0.mol

Synonyms:AMA 1080;AMA-1080;carumonam;Ro 17-2301;Ro-17-2301

Chemical Property of Carumonam sodium

Chemical Property:

• Melting Point: 250oC (dec.)(lit.)
• PSA: 295.73000
• Density: 2.13g/cm³
• LogP: -0.57280
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 8
• Exact Mass: 509.98517151
• Heavy Atom Count: 32
• Complexity: 839

Purity/Quality:

97% ^*data from raw suppliers

Carumonam disodium salt ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(N=C(S1)N)C(=NOCC(=O)[O-])C(=O)NC2C(N(C2=O)S(=O)(=O)[O-])COC(=O)N.[Na+].[Na+]
• Isomeric SMILES: C1=C(N=C(S1)N)/C(=N/OCC(=O)[O-])/C(=O)N[C@H]2[C@H](N(C2=O)S(=O)(=O)[O-])COC(=O)N.[Na+].[Na+]
• Uses: Carumonam Disodium Salt is a monobactam antibiotic.

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