John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=BjI4mDSi7Bo SpectraBase Spectrum ID=27UMlzzrwVr

(accessed ).
(3-S,4-S)-3-(BETA-D-GLUCOPYRANOSYLOXYMETHYL)-3,4-DIHYDRO-5,6,7-TRIHYDROXY-4-(4'-HYDROXY-3'-METHOXYPHENYL)-1H-[2]-BENZOPYRAN-1-ONE
SpectraBase Compound ID BjI4mDSi7Bo
InChI InChI=1S/C23H26O13/c1-33-12-4-8(2-3-10(12)25)15-14(7-34-23-21(31)20(30)18(28)13(6-24)36-23)35-22(32)9-5-11(26)17(27)19(29)16(9)15/h2-5,13-15,18,20-21,23-31H,6-7H2,1H3/t13-,14-,15-,18-,20+,21-,23-/m1/s1
InChIKey UHOPNSXEDGWYTB-VLMMQTNDSA-N
Mol Weight 510.45 g/mol
Molecular Formula C23H26O13
Exact Mass 510.137341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 27UMlzzrwVr
Name (3-S,4-S)-3-(BETA-D-GLUCOPYRANOSYLOXYMETHYL)-3,4-DIHYDRO-5,6,7-TRIHYDROXY-4-(4'-HYDROXY-3'-METHOXYPHENYL)-1H-[2]-BENZOPYRAN-1-ONE
Compound Number 1
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H26O13
InChI InChI=1S/C23H26O13/c1-33-12-4-8(2-3-10(12)25)15-14(7-34-23-21(31)20(30)18(28)13(6-24)36-23)35-22(32)9-5-11(26)17(27)19(29)16(9)15/h2-5,13-15,18,20-21,23-31H,6-7H2,1H3/t13-,14-,15-,18-,20+,21-,23-/m1/s1
InChIKey UHOPNSXEDGWYTB-VLMMQTNDSA-N
Literature Reference Author A.A.MAGID,L.VOUTQUENNE-NAZABADIOKO,G.MOROY,C.MORETTI,C.LAVAU D
Literature Reference Citation PHYTOCHEM.,68,2439(2007)
Literature Reference DOI 10.1016/j.phytochem.2007.05.011
Molecular Weight 510.452 g/mol
Sample ID 43378
Solvent CD3OD
SpectraBase Batch ID IUaRWPtb5Jq