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10-O-ACETYLPATRIONOSIDE-AGLYCONE-11-O-[4''-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-RIBOHEXO-3-ULOPYRANOSIDE]
SpectraBase Compound ID J4zka90rLPc
InChI InChI=1S/C31H46O17/c1-12(2)6-21(36)47-29-22-17(7-19(35)18(22)11-41-14(4)33)16(9-42-29)10-43-31-28(24(38)23(37)20(8-32)46-31)48-30-26(40)25(39)27(13(3)44-30)45-15(5)34/h9,12-13,17-20,22-23,25-32,35,37,39-40H,6-8,10-11H2,1-5H3/t13-,17-,18+,19+,20+,22+,23+,25-,26+,27-,28+,29+,30-,31+/m1/s1
InChIKey QDZCBAZYWGIRFP-KSGJKIARSA-N
Mol Weight 690.7 g/mol
Molecular Formula C31H46O17
Exact Mass 690.2735 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FFbHEsyYSt0
Name 10-O-ACETYLPATRIONOSIDE-AGLYCONE-11-O-[4''-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-RIBOHEXO-3-ULOPYRANOSIDE]
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H46O17
InChI InChI=1S/C31H46O17/c1-12(2)6-21(36)47-29-22-17(7-19(35)18(22)11-41-14(4)33)16(9-42-29)10-43-31-28(24(38)23(37)20(8-32)46-31)48-30-26(40)25(39)27(13(3)44-30)45-15(5)34/h9,12-13,17-20,22-23,25-32,35,37,39-40H,6-8,10-11H2,1-5H3/t13-,17-,18+,19+,20+,22+,23+,25-,26+,27-,28+,29+,30-,31+/m1/s1
InChIKey QDZCBAZYWGIRFP-KSGJKIARSA-N
Literature Reference Author V.PIERI,S.SCHWAIGER,E.P.ELLMERER,H.STUPPNER
Literature Reference Citation J.NAT.PROD.,72,1798(2009)
Literature Reference DOI 10.1021/np900373u
Molecular Weight 690.696 g/mol
Sample ID 33676
Solvent DMSO-D6