8-Dehydroxythienamycin
(5R,6R)-3-(2-aminoethylsulfanyl)-6-ethyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Also Known As: 8-Dehydroxythienamycin|Antibiotic NS-5|8-Deshydroxythienamycin|Deshydroxythienamycin|NS-5|NS 5|(5R,6R)-3-(2-aminoethylsulfanyl)-6-ethyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid|(5R,6R)-3-[(2-aminoethyl)sulfanyl]-6-ethyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid|1-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-((2-aminoethyl)thio)-6-ethyl-7-oxo-, (5R-cis)-|(5R)-3-[[2-Aminoethyl]thio]-6beta-ethyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid|(5R,6R)-3-((2-Aminoethyl)thio)-6-ethyl-7-oxo-1-azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid|(5R,6R)-3-(2-Aminoethylthio)-6-ethyl-7-oxo-1-azabicyclo[3.2.0]hepta-2-ene-2-carboxylic acid|1-Azabicyclo[3.2.0]hept-2-ene-2-carboxylicacid, 3-[(2-aminoethyl)thio]-6-ethyl-7-oxo-, (5R,6R)-
| Molecular Formula | C11H16N2O3S |
|---|---|
| Molecular Weight | 256.08817 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.08817 |
| Monoisotopic Mass | 256.08817 |
| Heavy Atoms | 17 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 74806-75-0 |
|---|---|
| SMILES | CC[C@@H]1[C@H]2CC(=C(N2C1=O)C(=O)O)SCCN |
| InChIKey | PSJNLRROOZKIHF-RNFRBKRXSA-N |
Product Overview
8-Dehydroxythienamycin (CAS 74806-75-0), with molecular formula C11H16N2O3S and molecular weight 256.08817 g/mol. IUPAC: (5R,6R)-3-(2-aminoethylsulfanyl)-6-ethyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid.
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