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8a-Adoxoside pentaacetate

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8a-Adoxoside pentaacetate
SpectraBase Compound ID GR0Gc0VTgss
InChI InChI=1S/C27H36O15/c1-12(28)35-9-17-7-8-18-19(25(33)34-6)10-37-26(21(17)18)42-27-24(40-16(5)32)23(39-15(4)31)22(38-14(3)30)20(41-27)11-36-13(2)29/h10,17-18,20-24,26-27H,7-9,11H2,1-6H3/t17?,18?,20-,21?,22-,23+,24-,26?,27+/m0/s1
InChIKey WVKGJCUSRQTBMY-KHRCHGJOSA-N
Mol Weight 600.6 g/mol
Molecular Formula C27H36O15
Exact Mass 600.20542 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5ZAI5m2QPde
Name 8a-Adoxoside pentaacetate
Comments C16 SIGNAL ASSIGNED TO 61.5 PPM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H36O15
InChI InChI=1S/C27H36O15/c1-12(28)35-9-17-7-8-18-19(25(33)34-6)10-37-26(21(17)18)42-27-24(40-16(5)32)23(39-15(4)31)22(38-14(3)30)20(41-27)11-36-13(2)29/h10,17-18,20-24,26-27H,7-9,11H2,1-6H3/t17?,18?,20-,21?,22-,23+,24-,26?,27+/m0/s1
InChIKey WVKGJCUSRQTBMY-KHRCHGJOSA-N
Literature Reference S. Damtoft, S. Jensen, Phytochem. 20, 2717 (1981).
NMR Standard see comment
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3