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DEHYDROGAERTNEROSIDE
SpectraBase Compound ID Bt5Bw1Ncet3
InChI InChI=1S/C26H26O13/c1-35-22(33)15-10-36-24(38-25-21(32)20(31)19(30)16(9-27)37-25)17-13(15)6-7-26(17)8-14(23(34)39-26)18(29)11-2-4-12(28)5-3-11/h2-8,10,13,16-17,19-21,24-25,27-28,30-32H,9H2,1H3/t13-,16+,17-,19+,20-,21+,24+,25-,26-/m1/s1
InChIKey POWUQYYCVSQIAC-FBYOWEDBSA-N
Mol Weight 546.48 g/mol
Molecular Formula C26H26O13
Exact Mass 546.137341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IQqb0z2ApGt
Name DEHYDROGAERTNEROSIDE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H26O13
InChI InChI=1S/C26H26O13/c1-35-22(33)15-10-36-24(38-25-21(32)20(31)19(30)16(9-27)37-25)17-13(15)6-7-26(17)8-14(23(34)39-26)18(29)11-2-4-12(28)5-3-11/h2-8,10,13,16-17,19-21,24-25,27-28,30-32H,9H2,1H3/t13-,16+,17-,19+,20-,21+,24+,25-,26-/m1/s1
InChIKey POWUQYYCVSQIAC-FBYOWEDBSA-N
Literature Reference Author K.CIMANGA,N.HERMANS,S.APERS,S.VANMIERT,H.VANDERHEUVEL,M.CLAE YS,L.PIETERS,A.VLIET
Literature Reference Citation J.NAT.PROD.,66,97(2003)
Literature Reference DOI 10.1021/np020215h
Molecular Weight 546.485 g/mol
Solvent CD3OD
Source File Reference UWSI16692