Penicillin K
3,3-dimethyl-6-(octanoylamino)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Penicillin K|Heptylpenicillin|Penicillin A|Penicillin IV|Octanoylpenicillin|3,3-dimethyl-6-(octanoylamino)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|3,3-Dimethyl-6-octanamido-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid|4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-6-octanamido-7-oxo-
| Molecular Formula | C16H26N2O4S |
|---|---|
| Molecular Weight | 342.16132 g/mol |
| LogP | 1.98 |
| Topological Polar Surface Area | 86.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 342.16132 |
| Heavy Atoms | 23 |
| Complexity | 494.5 |
Chemical Identifiers
| CAS Number | 525-97-3 |
|---|---|
| SMILES | CCCCCCCC(=O)NC1C2N(C1=O)C(C(S2)(C)C)C(=O)O |
Product Overview
Penicillin K (CAS 525-97-3), with molecular formula C16H26N2O4S and molecular weight 342.16132 g/mol. IUPAC: 3,3-dimethyl-6-(octanoylamino)-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
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