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Benzyl_2-o,o-DIETHYLPHOSPHOROTHIOATE_3,4,6-tri-o-benzyl-1-thio-beta-D-glycopyranoside

View entire compound with spectra: 2 NMR

Benzyl_2-o,o-DIETHYLPHOSPHOROTHIOATE_3,4,6-tri-o-benzyl-1-thio-beta-D-glycopyranoside
SpectraBase Compound ID 4ywNAihRzp1
InChI InChI=1S/C38H45O7PS2/c1-3-42-46(47,43-4-2)45-37-36(41-27-32-21-13-7-14-22-32)35(40-26-31-19-11-6-12-20-31)34(28-39-25-30-17-9-5-10-18-30)44-38(37)48-29-33-23-15-8-16-24-33/h5-24,34-38H,3-4,25-29H2,1-2H3/t34-,35-,36+,37-,38+/m0/s1
InChIKey DTDSFWCSBKAYRM-YWUGBPCLSA-N
Mol Weight 708.9 g/mol
Molecular Formula C38H45O7PS2
Exact Mass 708.234433 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BOiMNDUj1ce
Name Benzyl_2-o,o-DIETHYLPHOSPHOROTHIOATE_3,4,6-tri-o-benzyl-1-thio-beta-D-glycopyranoside
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 708.234433128 u
Formula C38H45O7PS2
InChI InChI=1S/C38H45O7PS2/c1-3-42-46(47,43-4-2)45-37-36(41-27-32-21-13-7-14-22-32)35(40-26-31-19-11-6-12-20-31)34(28-39-25-30-17-9-5-10-18-30)44-38(37)48-29-33-23-15-8-16-24-33/h5-24,34-38H,3-4,25-29H2,1-2H3/t34-,35-,36+,37-,38+/m0/s1
InChIKey DTDSFWCSBKAYRM-YWUGBPCLSA-N
Molecular Weight 708.865 g/mol
SMILES C(S[C@@]1([C@@](OP(=S)(OCC)OCC)([C@](OCC2=CC=CC=C2)([C@@](OCC2=CC=CC=C2)([C@@](O1)(COCC1=CC=CC=C1)[H])[H])[H])[H])[H])C=1C=CC=CC1