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| Name | 9,21-Dehydroryanodine |
|---|---|
| Synonyms | 9,21-Didehydroryanodine; 9,21-Didehydroryanodol 3-(1H-Pyrrole-2-Carboxylate); Ryanodol, 9,21-Didehydro-, 3-(1H-Pyrrole-2-Carboxylate) |
| Molecular Structure |  |
| Molecular Formula | C25H33NO9 |
| Molecular Weight | 491.54 |
| CAS Registry Number | 94513-55-0 |
| SMILES | [C@]24([C@]16[C@@](CCC([C@H]1O)=C)(O)[C@]5([C@@]2([C@H](OC(C3=CC=C[NH]3)=O)[C@@]([C@@]4([C@@](C5)(O)O6)C)(C(C)C)O)O)C)O |
| InChI | 1S/C25H33NO9/c1-12(2)22(31)17(34-16(28)14-7-6-10-26-14)23(32)18(4)11-21(30)19(22,5)25(23,33)24(35-21)15(27)13(3)8-9-20(18,24)29/h6-7,10,12,15,17,26-27,29-33H,3,8-9,11H2,1-2,4-5H3/t15-,17-,18+,19+,20+,21+,22-,23-,24-,25-/m1/s1 |
| InChIKey | BPFNBBLVUYSFRK-OHEPIYSBSA-N |
| Density | 1.578g/cm3 (Cal.) |
|---|---|
| Boiling point | 724.271°C at 760 mmHg (Cal.) |
| Flash point | 391.825°C (Cal.) |
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