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3-DEOXOHIRSUTANONOL-5-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 7zqdXdcdrFC
InChI InChI=1S/C25H34O10/c26-13-21-22(31)23(32)24(33)25(35-21)34-16(8-5-15-7-10-18(28)20(30)12-15)4-2-1-3-14-6-9-17(27)19(29)11-14/h6-7,9-12,16,21-33H,1-5,8,13H2/t16-,21-,22-,23+,24-,25-/m0/s1
InChIKey LSEDQFLRUJOXDX-IQJVAEQNSA-N
Mol Weight 494.5 g/mol
Molecular Formula C25H34O10
Exact Mass 494.215197 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CFB10yqOsa8
Name (3R)-1,7-BIS-(3,4-DIHYDROXYPHENYL)-3-(BETA-D-GLUCOPYRANOSYL)-HEPTAN-3-OL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H34O10
InChI InChI=1S/C25H34O10/c26-13-21-22(31)23(32)24(33)25(35-21)34-16(8-5-15-7-10-18(28)20(30)12-15)4-2-1-3-14-6-9-17(27)19(29)11-14/h6-7,9-12,16,21-33H,1-5,8,13H2/t16-,21-,22-,23+,24-,25-/m0/s1
InChIKey LSEDQFLRUJOXDX-IQJVAEQNSA-N
Literature Reference Author K.K.LEE,B.D.BAHLER,G.A.HOFMANN,M.R.MATTERN,R.K.JOHNSON,D.G.I .KINGSTON
Literature Reference Citation J.NAT.PROD.,61,1407(1998)
Literature Reference DOI 10.1021/np9801460
Molecular Weight 494.539 g/mol
Solvent CD3OD
Source File Reference UWCS19642