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PERUVIANOSIDE-III;QUERCETIN-3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-[ALPHA-L-RHAMNOPYRANOSYL-(1->6)]-BETA-D-GALACTOPYRANOSIDE]
SpectraBase Compound ID BVu79Nzbjsy
InChI InChI=1S/C33H40O21/c1-9-19(39)23(43)26(46)31(49-9)48-8-17-21(41)25(45)30(54-32-27(47)24(44)20(40)16(7-34)51-32)33(52-17)53-29-22(42)18-14(38)5-11(35)6-15(18)50-28(29)10-2-3-12(36)13(37)4-10/h2-6,9,16-17,19-21,23-27,30-41,43-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21-,23+,24-,25-,26+,27+,30+,31+,32-,33-/m0/s1
InChIKey MNMUPTOJETVJCW-CPGUHFRISA-N
Mol Weight 772.7 g/mol
Molecular Formula C33H40O21
Exact Mass 772.206208 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B3Ryzyy4kOm
Name PERUVIANOSIDE-III;QUERCETIN-3-O-[BETA-D-GLUCOPYRANOSYL-(1->2)-[ALPHA-L-RHAMNOPYRANOSYL-(1->6)]-BETA-D-GALACTOPYRANOSIDE]
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H40O21
InChI InChI=1S/C33H40O21/c1-9-19(39)23(43)26(46)31(49-9)48-8-17-21(41)25(45)30(54-32-27(47)24(44)20(40)16(7-34)51-32)33(52-17)53-29-22(42)18-14(38)5-11(35)6-15(18)50-28(29)10-2-3-12(36)13(37)4-10/h2-6,9,16-17,19-21,23-27,30-41,43-47H,7-8H2,1H3/t9-,16+,17+,19-,20+,21-,23+,24-,25-,26+,27+,30+,31+,32-,33-/m0/s1
InChIKey MNMUPTOJETVJCW-CPGUHFRISA-N
Literature Reference Author S.TEWTRAKUL,N.NAKAMURA,M.HATTORI,T.FUJIWARA,T.SUPAVITA
Literature Reference Citation CHEM.PHARM.BULL.,50,630(2002)
Literature Reference DOI 10.1248/cpb.50.630
Molecular Weight 772.668 g/mol
Solvent C5D5N
Source File Reference UWVN8143