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2-(4-HYDROXY-3-METHOXYPHENYL)-ETHANOL_1-O-[BETA-D-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE]
SpectraBase Compound ID 7n4MqIHXEZn
InChI InChI=1S/C20H30O12/c1-28-12-6-10(2-3-11(12)22)4-5-29-18-16(25)15(24)14(23)13(32-18)7-30-19-17(26)20(27,8-21)9-31-19/h2-3,6,13-19,21-27H,4-5,7-9H2,1H3/t13-,14-,15+,16-,17-,18-,19+,20+/m1/s1
InChIKey MYOINCYRVGGFRT-WYZVAZFISA-N
Mol Weight 462.45 g/mol
Molecular Formula C20H30O12
Exact Mass 462.173726 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JXFH0Cyf3Q4
Name 2-(4-HYDROXY-3-METHOXYPHENYL)-ETHANOL_1-O-[BETA-D-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE]
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O12
InChI InChI=1S/C20H30O12/c1-28-12-6-10(2-3-11(12)22)4-5-29-18-16(25)15(24)14(23)13(32-18)7-30-19-17(26)20(27,8-21)9-31-19/h2-3,6,13-19,21-27H,4-5,7-9H2,1H3/t13-,14-,15+,16-,17-,18-,19+,20+/m1/s1
InChIKey MYOINCYRVGGFRT-WYZVAZFISA-N
Literature Reference Author S.LIN,S.WANG,M.LIU,M.GAN,S.LI,Y.YANG,Y.WANG,W.HE,J.SHI
Literature Reference Citation J.NAT.PROD.,70,817(2007)
Literature Reference DOI 10.1021/np0700467
Molecular Weight 462.451 g/mol
Sample ID 30440
Solvent DMSO-D6