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2-Prenylhydroquinone-1-.beta.-D-glucoside, 5me derivative

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2-Prenylhydroquinone-1-.beta.-D-glucoside, 5me derivative
SpectraBase Compound ID NU0jl0LBM9
InChI InChI=1S/C22H34O7/c1-14(2)8-9-15-12-16(24-4)10-11-17(15)28-22-21(27-7)20(26-6)19(25-5)18(29-22)13-23-3/h8,10-12,18-22H,9,13H2,1-7H3/t18-,19-,20+,21-,22-/m1/s1
InChIKey VGQRXOXLXIWFBG-QMCAAQAGSA-N
Mol Weight 410.5 g/mol
Molecular Formula C22H34O7
Exact Mass 410.230453 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AIIlbyC6Q3m
Name 2-Prenylhydroquinone-1-.beta.-D-glucoside, 5me derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.230453428 u
Formula C22H34O7
InChI InChI=1S/C22H34O7/c1-14(2)8-9-15-12-16(24-4)10-11-17(15)28-22-21(27-7)20(26-6)19(25-5)18(29-22)13-23-3/h8,10-12,18-22H,9,13H2,1-7H3/t18-,19-,20+,21-,22-/m1/s1
InChIKey VGQRXOXLXIWFBG-QMCAAQAGSA-N
Molecular Weight 410.507 g/mol
SMILES C1(=C(C=C(C=C1)OC)CC=C(C)C)O[C@]1([C@](OC)([C@@](OC)([C@](OC)([C@](O1)(COC)[H])[H])[H])[H])[H]