HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 12817543Generated: October 26, 2026
(2R,3S,5R,6R) 2-(N-Acetyl)carbamoyloxymethyl-2-methyl-6-phenylacetamidopenam-3 carboxylic Acid p-Nitrobenzyl Ester
https://huagongshe.com/en/chemical/12817543
Identifiers & Physical Properties
| Molecular formula | C26H26N4O9S |
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| Average molar mass | 570.6 g/mol |
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| Monoisotopic mass | 570.14204959 g/mol |
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| SMILES | CC(=O)NC(=O)OC[C@]1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)OCc1ccc([N+](=O)[O-])cc1 |
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| InChIKey | JUVYUPMAXQZFHV-HRKISDNUSA-N |
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| PubChem CID | 12817543 |
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Chemical & Physical Properties
| XLogP | 2.6 |
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| Topological polar surface area | 202 |
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| Hydrogen bond donors | 2 |
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| Hydrogen bond acceptors | 10 |
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| Rotatable bonds | 10 |
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| Heavy atoms | 40 |
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| Formal charge | 0 |
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| Complexity | 1,020 |
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