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IXERISOSIDE-L
SpectraBase Compound ID 9FrvkE7NEGZ
InChI InChI=1S/C36H52O16/c1-17(2)25(39)33(46)50-22(14-19-6-8-20(38)9-7-19)32(45)52-24-11-13-36(47,16-49-34-29(43)28(42)27(41)23(15-37)51-34)30-26(40)21(10-12-35(24,30)4)18(3)31(44)48-5/h6-9,17,21-30,34,37-43,47H,3,10-16H2,1-2,4-5H3/t21-,22?,23-,24+,25?,26-,27-,28+,29-,30+,34-,35-,36+/m1/s1
InChIKey IXOSXWZLCNJRLS-RXMKHVHSSA-N
Mol Weight 740.8 g/mol
Molecular Formula C36H52O16
Exact Mass 740.325536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9u8BVyX7VO3
Name IXERISOSIDE-L
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H52O16
InChI InChI=1S/C36H52O16/c1-17(2)25(39)33(46)50-22(14-19-6-8-20(38)9-7-19)32(45)52-24-11-13-36(47,16-49-34-29(43)28(42)27(41)23(15-37)51-34)30-26(40)21(10-12-35(24,30)4)18(3)31(44)48-5/h6-9,17,21-30,34,37-43,47H,3,10-16H2,1-2,4-5H3/t21-,22?,23-,24+,25?,26-,27-,28+,29-,30+,34-,35-,36+/m1/s1
InChIKey IXOSXWZLCNJRLS-RXMKHVHSSA-N
Literature Reference Author T.WARASHINA,M.ISHINO,T.MIYASE,A.UENO
Literature Reference Citation PHYTOCHEM.,29,3217(1990)
Literature Reference DOI 10.1016/0031-9422(90)80188-M
Molecular Weight 740.799 g/mol
Solvent PYRIDINE-D5
Source File Reference UWKP6861