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.beta.-Morroniside pentaacetate
SpectraBase Compound ID 12PuPSboMEz
InChI InChI=1S/C27H36O16/c1-11-21-17(8-20(37-11)38-13(3)29)18(25(33)34-7)9-36-26(21)43-27-24(41-16(6)32)23(40-15(5)31)22(39-14(4)30)19(42-27)10-35-12(2)28/h9,11,17,19-24,26-27H,8,10H2,1-7H3
InChIKey HQWWWSGOFQAECN-UHFFFAOYSA-N
Mol Weight 616.6 g/mol
Molecular Formula C27H36O16
Exact Mass 616.200335 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5zRhEeQ3XoS
Name .alpha.-Morroniside pentaacetate
CAS Registry Number 25406-63-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H36O16
InChI InChI=1S/C27H36O16/c1-11-21-17(8-20(37-11)38-13(3)29)18(25(33)34-7)9-36-26(21)43-27-24(41-16(6)32)23(40-15(5)31)22(39-14(4)30)19(42-27)10-35-12(2)28/h9,11,17,19-24,26-27H,8,10H2,1-7H3
InChIKey HQWWWSGOFQAECN-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference K. Bock, S.R. Jensen, B.J. Nielsen, Acta Chem. Scand. B30, 743 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3