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6-Hydroxyflavanone-ß-D-glucoside

View entire compound with spectra: 1 NMR, 2 FTIR, and 1 Raman

6-Hydroxyflavanone-ß-D-glucoside
SpectraBase Compound ID 3NXTqhu8wE5
InChI InChI=1S/C21H20O8/c22-10-17-18(24)19(25)20(26)21(29-17)27-12-6-7-15-13(8-12)14(23)9-16(28-15)11-4-2-1-3-5-11/h1-9,17-22,24-26H,10H2/t17-,18-,19+,20-,21-/m1/s1
InChIKey IGLUETUHJXMGBD-YMQHIKHWSA-N
Mol Weight 400.38 g/mol
Molecular Formula C21H20O8
Exact Mass 400.115818 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hh82idCP8jS
Name 6-Hydroxyflavanone-ß-D-glucoside
Comments Computed using HOSE algorithm
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Exact Mass 400.115817596 u
Formula C21H20O8
InChI InChI=1S/C21H20O8/c22-10-17-18(24)19(25)20(26)21(29-17)27-12-6-7-15-13(8-12)14(23)9-16(28-15)11-4-2-1-3-5-11/h1-9,17-22,24-26H,10H2/t17-,18-,19+,20-,21-/m1/s1
InChIKey IGLUETUHJXMGBD-YMQHIKHWSA-N
Molecular Weight 400.383 g/mol
SMILES O[C@]1([C@@](O[C@@]([C@]([C@@]1(O)[H])(O)[H])(CO)[H])(OC1=CC=C2OC(=CC(C2=C1)=O)C=1C=CC=CC1)[H])[H]