HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 21982916Generated: November 2, 2026
5-Oxo-2-[[5-oxo-5-(2,3,4,5,6-pentahydroxyhexylamino)-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-5-(2,3,4,5,6-pentahydroxyhexylamino)pentanoic acid
https://huagongshe.com/en/chemical/21982916
Identifiers & Physical Properties
| Molecular formula | C30H48N4O17 |
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| Average molar mass | 736.7 g/mol |
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| Monoisotopic mass | 736.30144608 g/mol |
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| SMILES | O=C(CCC(NC(=O)C(CCC(=O)NCC(O)C(O)C(O)C(O)CO)NC(=O)OCc1ccccc1)C(=O)O)NCC(O)C(O)C(O)C(O)CO |
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| InChIKey | CAWVNRMDHQDTMH-UHFFFAOYSA-N |
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| PubChem CID | 21982916 |
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Chemical & Physical Properties
| XLogP | -6.7 |
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| Topological polar surface area | 365 |
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| Hydrogen bond donors | 15 |
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| Hydrogen bond acceptors | 17 |
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| Rotatable bonds | 25 |
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| Heavy atoms | 51 |
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| Formal charge | 0 |
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| Complexity | 1,080 |
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![5-Oxo-2-[[5-oxo-5-(2,3,4,5,6-pentahydroxyhexylamino)-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-5-(2,3,4,5,6-pentahydroxyhexylamino)pentanoic acid molecular structure](/img/chemical/21982916.png)