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GALACTOSYLMARTYNOSIDE;3-HYDROXY-4-METHOXYPHENETHYL-4'-FERULOYL-3'-(2''-BETA-D-GALACTOPYRANOSYL-ALPHA-L-RHAMNOPYRANOSYL)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 2cVcYP2XEee
InChI InChI=1S/C37H50O20/c1-16-26(43)29(46)34(57-36-30(47)28(45)27(44)23(14-38)53-36)37(52-16)56-33-31(48)35(51-11-10-18-5-8-21(49-2)20(41)12-18)54-24(15-39)32(33)55-25(42)9-6-17-4-7-19(40)22(13-17)50-3/h4-9,12-13,16,23-24,26-41,43-48H,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 WWMDKROTOPAYII-MRIPBCKNSA-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 IpWVyiXepuT
Name GALACTOSYLMARTYNOSIDE;3-HYDROXY-4-METHOXYPHENETHYL-4'-FERULOYL-3'-(2''-BETA-D-GALACTOPYRANOSYL-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 C37H50O20
InChI InChI=1S/C37H50O20/c1-16-26(43)29(46)34(57-36-30(47)28(45)27(44)23(14-38)53-36)37(52-16)56-33-31(48)35(51-11-10-18-5-8-21(49-2)20(41)12-18)54-24(15-39)32(33)55-25(42)9-6-17-4-7-19(40)22(13-17)50-3/h4-9,12-13,16,23-24,26-41,43-48H,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 WWMDKROTOPAYII-MRIPBCKNSA-N
Literature Reference Author M.TAKASAKI,I.YAMAUCHI,M.HARUNA,T.KONOSHIMA
Literature Reference Citation J.NAT.PROD.,61,1105(1998)
Literature Reference DOI 10.1021/np980148k
Molecular Weight 814.792 g/mol
Solvent CD3OD
Source File Reference UWCP2104