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TRICIN-4'-O-(ERYTHRO-BETA-GUAIACYLGLYCERYL)-ETHER-7''-O-BETA-D-GLUCOPYRANOSE
SpectraBase Compound ID I6oaTLbMQn4
InChI InChI=1S/C33H36O16/c1-43-21-6-14(4-5-17(21)37)31(49-33-30(42)29(41)28(40)25(12-34)48-33)26(13-35)47-32-23(44-2)7-15(8-24(32)45-3)20-11-19(39)27-18(38)9-16(36)10-22(27)46-20/h4-11,25-26,28-31,33-38,40-42H,12-13H2,1-3H3/t25-,26?,28-,29+,30-,31?,33+/m1/s1
InChIKey VXVGDCWUQYUZOA-ZLFJUGLFSA-N
Mol Weight 688.6 g/mol
Molecular Formula C33H36O16
Exact Mass 688.200335 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1gKrmbeFiHn
Name TRICIN-4'-O-(ERYTHRO-BETA-GUAIACYLGLYCERYL)-ETHER-7''-O-BETA-D-GLUCOPYRANOSE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H36O16
InChI InChI=1S/C33H36O16/c1-43-21-6-14(4-5-17(21)37)31(49-33-30(42)29(41)28(40)25(12-34)48-33)26(13-35)47-32-23(44-2)7-15(8-24(32)45-3)20-11-19(39)27-18(38)9-16(36)10-22(27)46-20/h4-11,25-26,28-31,33-38,40-42H,12-13H2,1-3H3/t25-,26?,28-,29+,30-,31?,33+/m1/s1
InChIKey VXVGDCWUQYUZOA-ZLFJUGLFSA-N
Literature Reference Author S.S.LEE,N.I.BAEK,Y.S.BAEK,D.K.CHUNG,M.C.SONG,M.H.BANG
Literature Reference Citation MOLECULES,20,5616(2015)
Literature Reference DOI 10.3390/molecules20045616
Molecular Weight 688.639 g/mol
Solvent C5D5N
Source File Reference UWPA3064