[(3aS,4R)-2,6-diamino-10,10-dihydroxy-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purin-4-yl]methyl carbamate,4-bromobenzenesulfonic acid structure
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Common Name | [(3aS,4R)-2,6-diamino-10,10-dihydroxy-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purin-4-yl]methyl carbamate,4-bromobenzenesulfonic acid | ||
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| CAS Number | 55803-45-7 | Molecular Weight | 773.42900 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C22H27Br2N7O10S2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
| Name | [(3aS,4R)-2,6-diamino-10,10-dihydroxy-3a,4,8,9-tetrahydro-3H-pyrrolo[1,2-c]purin-4-yl]methyl carbamate,4-bromobenzenesulfonic acid |
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| Synonym | More Synonyms |
| Molecular Formula | C22H27Br2N7O10S2 |
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| Molecular Weight | 773.42900 |
| Exact Mass | 770.96300 |
| PSA | 306.30000 |
| LogP | 3.75810 |
| InChIKey | XUOCKYZOBFYRGN-LMNIGVHWSA-N |
| SMILES | NC(=O)OCC1N=C(N)N2CCC(O)(O)C23NC(N)=NC13.O=S(=O)(O)c1ccc(Br)cc1.O=S(=O)(O)c1ccc(Br)cc1 |
| 4-bromobenzenesulfonic acid |
| Saxitoxin p-bromobenzenesulfonate |