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LIGUROBUSTOSIDE-M;[2-(4-HYDROXYPHENYLETHYL)]-[3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 7uG1F7gU6Gi
InChI InChI=1S/C26H40O15/c1-10-15(29)17(31)19(33)25(37-10)40-22-11(2)38-26(20(34)18(22)32)41-23-16(30)14(9-27)39-24(21(23)35)36-8-7-12-3-5-13(28)6-4-12/h3-6,10-11,14-35H,7-9H2,1-2H3/t10-,11+,14-,15-,16-,17+,18+,19+,20-,21-,22+,23+,24-,25-,26+/m1/s1
InChIKey PZNQCWWNVMGWAG-YCKYFAHBSA-N
Mol Weight 592.6 g/mol
Molecular Formula C26H40O15
Exact Mass 592.236721 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2HsH6itMVW2
Name LIGUROBUSTOSIDE-M;[2-(4-HYDROXYPHENYLETHYL)]-[3-O-ALPHA-L-RHAMNOPYRANOSYL-(1->4)-ALPHA-L-RHAMNOPYRANOSYL]-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H40O15
InChI InChI=1S/C26H40O15/c1-10-15(29)17(31)19(33)25(37-10)40-22-11(2)38-26(20(34)18(22)32)41-23-16(30)14(9-27)39-24(21(23)35)36-8-7-12-3-5-13(28)6-4-12/h3-6,10-11,14-35H,7-9H2,1-2H3/t10-,11+,14-,15-,16-,17+,18+,19+,20-,21-,22+,23+,24-,25-,26+/m1/s1
InChIKey PZNQCWWNVMGWAG-YCKYFAHBSA-N
Literature Reference Author Z.D.HE,K.M.LAU,P.P.H.BUT,R.W.JIANG,H.DONG,S.C.MA,K.P.FUNG,W. C.YE,H.D.SUN
Literature Reference Citation J.NAT.PROD.,66,851(2003)
Literature Reference DOI 10.1021/np020568g
Molecular Weight 592.595 g/mol
Solvent CD3OD
Source File Reference UWSI7920