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RHEMANEOLIGNAN-C;4-O-BETA-D-GLUCOPYRANOSIDE-2-BENZHYDRYL-3-HYDROXYMETHYL-BUTANE-1,4-DIOL
SpectraBase Compound ID G9MrpyRDhQd
InChI InChI=1S/C26H36O12/c1-35-19-7-13(3-5-17(19)31)22(16(11-29)15(9-27)10-28)14-4-6-18(20(8-14)36-2)37-26-25(34)24(33)23(32)21(12-30)38-26/h3-8,15-16,21-34H,9-12H2,1-2H3/t16?,21-,22?,23-,24+,25-,26-/m1/s1
InChIKey JTQRZLBIEVWWGL-ZFORVQRMSA-N
Mol Weight 540.6 g/mol
Molecular Formula C26H36O12
Exact Mass 540.220677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2WQ5TdJOBBd
Name RHEMANEOLIGNAN-C;4-O-BETA-D-GLUCOPYRANOSIDE-2-BENZHYDRYL-3-HYDROXYMETHYL-BUTANE-1,4-DIOL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H36O12
InChI InChI=1S/C26H36O12/c1-35-19-7-13(3-5-17(19)31)22(16(11-29)15(9-27)10-28)14-4-6-18(20(8-14)36-2)37-26-25(34)24(33)23(32)21(12-30)38-26/h3-8,15-16,21-34H,9-12H2,1-2H3/t16?,21-,22?,23-,24+,25-,26-/m1/s1
InChIKey JTQRZLBIEVWWGL-ZFORVQRMSA-N
Literature Reference Author M.LI,X.WANG,X.ZHENG,J.WANG,W.ZHAO,K.SONG,X.ZHAO,Y.ZHANG,H.KU ANG,W.FENG
Literature Reference Citation MOLECULES,20,15192(2015)
Literature Reference DOI 10.3390/molecules200815192
Molecular Weight 540.565 g/mol
Solvent CD3OD
Source File Reference UWPA5023