John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4ESnjhuhkyU SpectraBase Spectrum ID=FLsm3T1rbHJ

(accessed ).
THUNBERGINOL-D-3'-O-BETA-D-GLUCOPYRANOSIDE;MAJOR-DIASTEREOISOMER
SpectraBase Compound ID 4ESnjhuhkyU
InChI InChI=1S/C21H22O11/c22-7-15-17(26)18(27)19(28)21(32-15)31-14-4-8(1-2-11(14)24)13-5-9-3-10(23)6-12(25)16(9)20(29)30-13/h1-4,6,13,15,17-19,21-28H,5,7H2/t13?,15-,17-,18+,19-,21-/m0/s1
InChIKey BKJGXMNQCIUMDE-PEYUMJCJSA-N
Mol Weight 450.4 g/mol
Molecular Formula C21H22O11
Exact Mass 450.116212 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FLsm3T1rbHJ
Name THUNBERGINOL-D-3'-O-BETA-D-GLUCOPYRANOSIDE;MINOR-DIASTEREOISOMER
Compound Number 6
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22O11
InChI InChI=1S/C21H22O11/c22-7-15-17(26)18(27)19(28)21(32-15)31-14-4-8(1-2-11(14)24)13-5-9-3-10(23)6-12(25)16(9)20(29)30-13/h1-4,6,13,15,17-19,21-28H,5,7H2/t13?,15-,17-,18+,19-,21-/m0/s1
InChIKey BKJGXMNQCIUMDE-PEYUMJCJSA-N
Literature Reference Author J.LIU,S.NAKAMURA,Y.ZHUANG,M.YOSHIKAWA,G.M.E.HUSSEIN,K.MATSUO ,H.MATSUDA
Literature Reference Citation CHEM.PHARM.BULL.,61,655(2013)
Literature Reference DOI 10.1248/cpb.c13-00160
Molecular Weight 450.399 g/mol
Source File Reference UWIR3931
SpectraBase Batch ID IUiAmCxXN06