HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 463518Generated: November 1, 2026
N-(3beta-Hydroxy-30-aminolup-20(29)-en-28-oyl)-11-aminoundecanoic acid
https://huagongshe.com/en/chemical/463518
Identifiers & Physical Properties
| CAS No. | 173106-43-9 |
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| Molecular formula | C41H70N2O4 |
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| Average molar mass | 655 g/mol |
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| Monoisotopic mass | 654.53355872 g/mol |
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| SMILES | C=C(CN)[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 | RTCCFHDTQNDZCV-OMDZWSJNSA-N |
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| PubChem CID | 463518 |
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| DTXSID | DTXSID60938315 |
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Chemical & Physical Properties
| XLogP | 7.4 |
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| Topological polar surface area | 113 |
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| Hydrogen bond donors | 4 |
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| Hydrogen bond acceptors | 5 |
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| Rotatable bonds | 14 |
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| Heavy atoms | 47 |
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| Formal charge | 0 |
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| Complexity | 1,150 |
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