Introduction:Basic information about CAS 791635-59-1|simotaxel, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | simotaxel |
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| CAS Number | 791635-59-1 | Molecular Weight | 896.00700 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C46H57NO15S | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | simotaxel |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Molecular Formula | C46H57NO15S |
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| Molecular Weight | 896.00700 |
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| Exact Mass | 895.34500 |
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| PSA | 258.76000 |
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| LogP | 5.06300 |
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| InChIKey | SLGIWUWTSWJBQE-VLCCYYTCSA-N |
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| SMILES | CC(=O)OC12COC1CC(O)C1(C)C(=O)C(OC(=O)C3CCCC3)C3=C(C)C(OC(=O)C(O)C(NC(=O)OC(C)C)c4cccs4)CC(O)(C(OC(=O)c4ccccc4)C21)C3(C)C |
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Synonyms