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(3R)-1,7-BIS-(4-HYDROXYPHENYL)-3-HEPTANOL-3-O-BETA-D-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 7vrzIPL34ny
InChI InChI=1S/C30H42O12/c31-16-30(38)17-40-29(27(30)37)39-15-23-24(34)25(35)26(36)28(42-23)41-22(14-9-19-7-12-21(33)13-8-19)4-2-1-3-18-5-10-20(32)11-6-18/h5-8,10-13,22-29,31-38H,1-4,9,14-17H2/t22-,23-,24-,25+,26-,27-,28-,29+,30+/m0/s1
InChIKey JLMGCBFIPZDHLZ-RWCXMETFSA-N
Mol Weight 594.7 g/mol
Molecular Formula C30H42O12
Exact Mass 594.267627 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9oriMwLB78z
Name (3R)-1,7-BIS-(4-HYDROXYPHENYL)-3-HEPTANOL-3-O-BETA-D-APIOFURANOSYL-(1->6)-BETA-D-GLUCOPYRANOSIDE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H42O12
InChI InChI=1S/C30H42O12/c31-16-30(38)17-40-29(27(30)37)39-15-23-24(34)25(35)26(36)28(42-23)41-22(14-9-19-7-12-21(33)13-8-19)4-2-1-3-18-5-10-20(32)11-6-18/h5-8,10-13,22-29,31-38H,1-4,9,14-17H2/t22-,23-,24-,25+,26-,27-,28-,29+,30+/m0/s1
InChIKey JLMGCBFIPZDHLZ-RWCXMETFSA-N
Literature Reference Author E.SMITE,L.N.LUNDGREN,R.ANDERSSON
Literature Reference Citation PHYTOCHEM.,32,365(1993)
Literature Reference DOI 10.1016/S0031-9422(00)94995-1
Molecular Weight 594.656 g/mol
Solvent CD3OD
Source File Reference UWMS3632