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9,21-Didehydroryanodol
[CAS# 106821-54-9]

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CAS#: 106821-54-9
Product: 9,21-Didehydroryanodol
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Identification
Name 9,21-Didehydroryanodol
Synonyms Ryanodol, 9,21-Didehydro-; 9,21-Didehydroryanodol
Molecular Structure CAS#: 106821-54-9, 9,21-Didehydroryanodol
Molecular Formula C20H30O8
Molecular Weight 398.45
CAS Registry Number 106821-54-9
SMILES [C@]12(O)C34OC5(O)[C@]1([C@](O)([C@@H](O)[C@@]2(O)C([C@@]3(O)CCC([C@H]4O)=C)(C5)C)C(C)C)C
InChI 1S/C20H30O8/c1-9(2)17(25)12(22)18(26)13(4)8-16(24)14(17,5)20(18,27)19(28-16)11(21)10(3)6-7-15(13,19)23/h9,11-12,21-27H,3,6-8H2,1-2,4-5H3/t11-,12-,13?,14+,15+,16?,17-,18-,19?,20-/m1/s1
InChIKey VMZSULUKHWFTRZ-ARRUMGLCSA-N
Properties
Density 1.585g/cm3 (Cal.)
Boiling point 584.368°C at 760 mmHg (Cal.)
Flash point 307.215°C (Cal.)
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