HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 3051685Generated: November 4, 2026
2,3-Dihydroxybutanedioic acid--2-(6-ethylergolin-8-yl)ethanimidic acid (1/1)
https://huagongshe.com/en/chemical/3051685
Identifiers & Physical Properties
| CAS No. | 67658-42-8 |
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| Molecular formula | C22H29N3O7 |
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| Average molar mass | 447.5 g/mol |
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| Monoisotopic mass | 447.20055027 g/mol |
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| SMILES | CCN1C[C@H](CC(N)=O)CC2c3cccc4[nH]cc(c34)C[C@H]21.O=C(O)[C@H](O)[C@@H](O)C(=O)O |
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| InChIKey | AIDLZXIROZMUHT-FJZFASHUSA-N |
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| PubChem CID | 3051685 |
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| DTXSID | DTXSID50987019 |
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Chemical & Physical Properties
| Topological polar surface area | 177 |
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| Hydrogen bond donors | 6 |
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| Hydrogen bond acceptors | 8 |
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| Rotatable bonds | 6 |
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| Heavy atoms | 32 |
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| Formal charge | 0 |
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| Complexity | 574 |
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