HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 463520Generated: November 1, 2026
N-(3beta-Hydroxy-28-norlup-20(29)-en-28-oyl)-11-aminoundecanoic acid
https://huagongshe.com/en/chemical/463520
Identifiers & Physical Properties
| CAS No. | 173106-48-4 |
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| Molecular formula | C40H68N2O4 |
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| Average molar mass | 641 g/mol |
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| Monoisotopic mass | 640.51790865 g/mol |
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| SMILES | C=C(C)[C@@H]1CC[C@]2(NC(=O)NCCCCCCCCCC(=O)O)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12 |
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| InChIKey | AZGPQXCLZZYEES-IJMADOHJSA-N |
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| PubChem CID | 463520 |
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| DTXSID | DTXSID40938318 |
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Chemical & Physical Properties
| XLogP | 10.2 |
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| Topological polar surface area | 98.7 |
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| Hydrogen bond donors | 4 |
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| Hydrogen bond acceptors | 4 |
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| Rotatable bonds | 12 |
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| Heavy atoms | 46 |
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| Formal charge | 0 |
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| Complexity | 1,140 |
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