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6'-O-BETA-D-GLUCOPYRANOSYL-MARTYNOSIDE;3-HYDROXY-4-METHOXYPHENETHYLOXY-BETA-D-(3'-O-ALPHA-L-RHAMNOPYRANOSYL-4'-O-FERULOYL-6'-O-BETA-D-GLUCOPYRANOSYL)-GLUCOPYRA
SpectraBase Compound ID 4w9CWeI3WTk
InChI InChI=1S/C37H50O20/c1-16-26(42)28(44)31(47)37(53-16)57-34-32(48)36(51-11-10-18-5-8-21(49-2)20(40)12-18)55-24(15-52-35-30(46)29(45)27(43)23(14-38)54-35)33(34)56-25(41)9-6-17-4-7-19(39)22(13-17)50-3/h4-9,12-13,16,23-24,26-40,42-48H,10-11,14-15H2,1-3H3/b9-6+/t16-,23+,24-,26-,27+,28+,29-,30+,31-,32-,33-,34-,35+,36-,37+/m0/s1
InChIKey FXFHFOSEURHWMO-MKJKMRBCSA-N
Mol Weight 814.8 g/mol
Molecular Formula C37H50O20
Exact Mass 814.289544 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ct5rp1X8ubb
Name 6'-O-BETA-D-GLUCOPYRANOSYL-MARTYNOSIDE;3-HYDROXY-4-METHOXYPHENETHYLOXY-BETA-D-(3'-O-ALPHA-L-RHAMNOPYRANOSYL-4'-O-FERULOYL-6'-O-BETA-D-GLUCOPYRANOSYL)-GLUCOPYRA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H50O20
InChI InChI=1S/C37H50O20/c1-16-26(42)28(44)31(47)37(53-16)57-34-32(48)36(51-11-10-18-5-8-21(49-2)20(40)12-18)55-24(15-52-35-30(46)29(45)27(43)23(14-38)54-35)33(34)56-25(41)9-6-17-4-7-19(39)22(13-17)50-3/h4-9,12-13,16,23-24,26-40,42-48H,10-11,14-15H2,1-3H3/b9-6+/t16-,23+,24-,26-,27+,28+,29-,30+,31-,32-,33-,34-,35+,36-,37+/m0/s1
InChIKey FXFHFOSEURHWMO-MKJKMRBCSA-N
Literature Reference Author K.YUASA,T.IDE,H.OTSUKA,Y.TAKEDA
Literature Reference Citation J.NAT.PROD.,56,1695(1993)
Literature Reference DOI 10.1021/np50100a006
Molecular Weight 814.792 g/mol
Solvent CD3OD
Source File Reference UWCS4701