HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86740407Generated: October 29, 2026
sodium (3R,4S)-4-acetylthio-3-[2-(2-aminothiazol-4-yl)-2-methoxyiminoacetamido]-2-oxoazetidine-1-sulfonate
https://huagongshe.com/en/chemical/86740407
Identifiers & Physical Properties
| Molecular formula | C11H12N5NaO7S3 |
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| Average molar mass | 445.4 g/mol |
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| Monoisotopic mass | 444.97965554 g/mol |
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| SMILES | CON=C(C(=O)N[C@@H]1C(=O)N(S(=O)(=O)[O-])[C@H]1SC(C)=O)c1csc(N)n1.[Na+] |
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| InChIKey | OBCIYLNDANCOEV-QJVKKXMWSA-M |
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| PubChem CID | 86740407 |
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Chemical & Physical Properties
| Topological polar surface area | 246 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 12 |
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| Rotatable bonds | 7 |
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| Heavy atoms | 27 |
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| Formal charge | 0 |
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| Complexity | 743 |
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![sodium (3R,4S)-4-acetylthio-3-[2-(2-aminothiazol-4-yl)-2-methoxyiminoacetamido]-2-oxoazetidine-1-sulfonate molecular structure](/img/chemical/86740407.png)