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ISOVIBURTINOSIDE-III
SpectraBase Compound ID ALqI2VXWat7
InChI InChI=1S/C32H42O15/c1-4-16(2)29(40)47-30-25-21(11-23(36)32(25,41)15-44-17(3)34)19(13-42-30)14-43-31-28(27(39)26(38)22(12-33)45-31)46-24(37)10-7-18-5-8-20(35)9-6-18/h5-10,13,16,21-23,25-28,30-31,33,35-36,38-39,41H,4,11-12,14-15H2,1-3H3/b10-7-/t16?,21-,22+,23+,25-,26+,27-,28+,30+,31+,32-/m1/s1
InChIKey AAPLRLFRMAAIBE-BSLVDIQTSA-N
Mol Weight 666.7 g/mol
Molecular Formula C32H42O15
Exact Mass 666.252371 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DZojNEKK8OR
Name ISOVIBURTINOSIDE-III
Compound Number 318
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H42O15
InChI InChI=1S/C32H42O15/c1-4-16(2)29(40)47-30-25-21(11-23(36)32(25,41)15-44-17(3)34)19(13-42-30)14-43-31-28(27(39)26(38)22(12-33)45-31)46-24(37)10-7-18-5-8-20(35)9-6-18/h5-10,13,16,21-23,25-28,30-31,33,35-36,38-39,41H,4,11-12,14-15H2,1-3H3/b10-7-/t16?,21-,22+,23+,25-,26+,27-,28+,30+,31+,32-/m1/s1
InChIKey AAPLRLFRMAAIBE-BSLVDIQTSA-N
Literature Reference Author B.DINDA,S.DEBNATH,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,55,159(2007)
Literature Reference DOI 10.1248/cpb.55.159
Molecular Weight 666.676 g/mol
Sample ID 38114
Solvent CD3OD