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(4-Hydroxyphenyl)methyl .beta.-D-glucopyranoside, 5me derivative

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

(4-Hydroxyphenyl)methyl .beta.-D-glucopyranoside, 5me derivative
SpectraBase Compound ID 1A3i25IQahK
InChI InChI=1S/C18H28O7/c1-19-11-14-15(21-3)16(22-4)17(23-5)18(25-14)24-10-12-6-8-13(20-2)9-7-12/h6-9,14-18H,10-11H2,1-5H3/t14-,15-,16+,17-,18-/m1/s1
InChIKey BRMGVEXFBSRHGX-UYTYNIKBSA-N
Mol Weight 356.42 g/mol
Molecular Formula C18H28O7
Exact Mass 356.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1eMATU7yrJi
Name (4-Hydroxyphenyl)methyl .beta.-D-glucopyranoside, 5me derivative
Comments Computed using HOSE algorithm
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Exact Mass 356.183503235 u
Formula C18H28O7
InChI InChI=1S/C18H28O7/c1-19-11-14-15(21-3)16(22-4)17(23-5)18(25-14)24-10-12-6-8-13(20-2)9-7-12/h6-9,14-18H,10-11H2,1-5H3/t14-,15-,16+,17-,18-/m1/s1
InChIKey BRMGVEXFBSRHGX-UYTYNIKBSA-N
Molecular Weight 356.415 g/mol
SMILES [C@@]1(OCC2=CC=C(C=C2)OC)([C@](OC)([C@@](OC)([C@](OC)([C@](O1)(COC)[H])[H])[H])[H])[H]