HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 463516Generated: October 31, 2026
Undecanoic acid, 11-(((3beta)-30-((carboxymethyl)amino)-3-hydroxy-28-oxolup-20(29)-en-28-yl)amino)-
https://huagongshe.com/en/chemical/463516
Identifiers & Physical Properties
| CAS No. | 173106-40-6 |
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| Molecular formula | C43H72N2O6 |
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| Average molar mass | 713 g/mol |
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| Monoisotopic mass | 712.53903802 g/mol |
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| SMILES | C=C(CNCC(=O)O)[C@@H]1CC[C@]2(C(=O)NCCCCCCCCCCC(=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 | SESXEXHHXGFZGS-MEUQDLEQSA-N |
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| PubChem CID | 463516 |
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| DTXSID | DTXSID00938314 |
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Chemical & Physical Properties
| XLogP | 7.6 |
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| Topological polar surface area | 136 |
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| Hydrogen bond donors | 5 |
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| Hydrogen bond acceptors | 7 |
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| Rotatable bonds | 17 |
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| Heavy atoms | 51 |
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| Formal charge | 0 |
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| Complexity | 1,280 |
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