3-Furylmethylpenicillin
(2S,5R,6R)-6-[[2-(furan-3-yl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: 3-Furylmethylpenicillin|(2S,5R,6R)-6-[[2-(furan-3-yl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 6-((3-furanylacetyl)amino)-3,3-dimethyl-7-oxo-, (2S-(2alpha,5alpha,6beta))-|(2s,5r,6r)-6-[(2-furan-3-ylacetyl)amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid|(2S,5R,6R)-6-[2-(FURAN-3-YL)ACETAMIDO]-3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-2-CARBOXYLIC ACID
| Molecular Formula | C14H16N2O5S |
|---|---|
| Molecular Weight | 324.078 g/mol |
| LogP | 0.4538 |
| Topological Polar Surface Area | 99.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 324.078 |
| Monoisotopic Mass | 324.078 |
| Heavy Atoms | 22 |
| Complexity | 627.1875 |
Chemical Identifiers
| CAS Number | 35987-91-8 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)CC3=COC=C3)C(=O)O)C |
Product Overview
3-Furylmethylpenicillin (CAS 35987-91-8), with molecular formula C14H16N2O5S and molecular weight 324.078 g/mol. IUPAC: (2S,5R,6R)-6-[[2-(furan-3-yl)acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
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