Suncillin
(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[2-phenyl-2-(sulfoamino)acetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
Also Known As: Suncillin, 6-(D-alpha-Sulfoaminophenylacetamido)penicillanic acid, (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[2-phenyl-2-(sulfoamino)acetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, (2s,5r,6r)-3,3-dimethyl-7-oxo-6-{[phenyl(sulfoamino)acetyl]amino}-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-7-oxo-6-[[phenyl(sulfoamino)acetyl]amino]-, [2S-[2.alpha.,5.alpha.,6.beta.(S*)]]-, 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[2-phenyl-2-(sulfoamino)acetamido]-, D-
| Molecular Formula | C16H19N3O7S2 |
|---|---|
| Molecular Weight | 429.06644 g/mol |
| LogP | -0.25 |
| Topological Polar Surface Area | 153.11 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 429.06644 |
| Heavy Atoms | 28 |
| Complexity | 919 |
Chemical Identifiers
| CAS Number | 22164-94-9 |
|---|---|
| SMILES | CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)NC(=O)C(C3=CC=CC=C3)NS(=O)(=O)O)C(=O)O)C |
Product Overview
Suncillin (CAS 22164-94-9), with molecular formula C16H19N3O7S2 and molecular weight 429.06644 g/mol. IUPAC: (2S,5R,6R)-3,3-dimethyl-7-oxo-6-[[2-phenyl-2-(sulfoamino)acetyl]amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid.
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