John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=FvnKhdcl2KT SpectraBase Spectrum ID=2WaLmIi8WyV

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6-ISOPROPYL-5-(N-OCTYL-BETA-GLUCOPYRANOSYL)-TROPOLONE-BETA-GLUCOPYRANOSIDE
SpectraBase Compound ID FvnKhdcl2KT
InChI InChI=1S/C30H48O13/c1-16(2)18-13-19(33)20(41-30-28(39)26(37)24(35)22(15-32)43-30)11-10-17(18)9-7-5-3-4-6-8-12-40-29-27(38)25(36)23(34)21(14-31)42-29/h10-11,13,16,21-32,34-39H,3-9,12,14-15H2,1-2H3/t21-,22+,23-,24+,25+,26-,27-,28+,29-,30+/m1/s1
InChIKey ICQCRVQFADBOKH-XOAIYJMQSA-N
Mol Weight 616.7 g/mol
Molecular Formula C30H48O13
Exact Mass 616.309492 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2WaLmIi8WyV
Name 6-ISOPROPYL-5-(N-OCTYL-BETA-GLUCOPYRANOSYL)-TROPOLONE-BETA-GLUCOPYRANOSIDE
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H48O13
InChI InChI=1S/C30H48O13/c1-16(2)18-13-19(33)20(41-30-28(39)26(37)24(35)22(15-32)43-30)11-10-17(18)9-7-5-3-4-6-8-12-40-29-27(38)25(36)23(34)21(14-31)42-29/h10-11,13,16,21-32,34-39H,3-9,12,14-15H2,1-2H3/t21-,22+,23-,24+,25+,26-,27-,28+,29-,30+/m1/s1
InChIKey ICQCRVQFADBOKH-XOAIYJMQSA-N
Literature Reference Author Z.MADAR,H.E.GOTTLIEB,M.COJOCARU,J.RIOV,Z.SOLEL,A.SZTEJNBERG
Literature Reference Citation PHYTOCHEM.,38,351(1995)
Literature Reference DOI 10.1016/0031-9422(94)00575-E
Molecular Weight 616.703 g/mol
Solvent CD3OD
Source File Reference UWMS4725
SpectraBase Batch ID I27ZiEeMvwA