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7-O-ACETYLPATRIONOSIDE-AGLYCONE-11-O-[4''-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-RIBOHEXO-3-ULOPYRANOSIDE]
SpectraBase Compound ID 5GM8jTDp1uu
InChI InChI=1S/C31H46O17/c1-12(2)6-21(36)47-29-22-17(7-19(18(22)8-32)44-14(4)34)16(10-41-29)11-42-31-28(24(38)23(37)20(9-33)46-31)48-30-26(40)25(39)27(13(3)43-30)45-15(5)35/h10,12-13,17-20,22-23,25-33,37,39-40H,6-9,11H2,1-5H3/t13-,17-,18+,19+,20+,22+,23+,25-,26+,27-,28+,29+,30-,31+/m1/s1
InChIKey QYGPZIRPZLJQFG-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 GVcjsIwLTNM
Name 7-O-ACETYLPATRIONOSIDE-AGLYCONE-11-O-[4''-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYL-(1->2)-BETA-D-RIBOHEXO-3-ULOPYRANOSIDE]
Compound Number 2
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(18(22)8-32)44-14(4)34)16(10-41-29)11-42-31-28(24(38)23(37)20(9-33)46-31)48-30-26(40)25(39)27(13(3)43-30)45-15(5)35/h10,12-13,17-20,22-23,25-33,37,39-40H,6-9,11H2,1-5H3/t13-,17-,18+,19+,20+,22+,23+,25-,26+,27-,28+,29+,30-,31+/m1/s1
InChIKey QYGPZIRPZLJQFG-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 33678
Solvent C5D5N