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(2'S,3'R,5'R)-2-[5-(Tert-butyldimethylsilyloxy)-1,3-dihydroxy-2-(phenylmethoxy)hexyl]-4,8-dimethoxy-1-naphthol
SpectraBase Compound ID 6WbXjMTpJ7Z
InChI InChI=1S/C31H44O7Si/c1-20(38-39(7,8)31(2,3)4)17-24(32)30(37-19-21-13-10-9-11-14-21)29(34)23-18-26(36-6)22-15-12-16-25(35-5)27(22)28(23)33/h9-16,18,20,24,29-30,32-34H,17,19H2,1-8H3/t20-,24-,29?,30+/m1/s1
InChIKey IWVXPDUECGKEOP-RKEVWMKSSA-N
Mol Weight 556.8 g/mol
Molecular Formula C31H44O7Si
Exact Mass 556.28563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C17nCMp0G10
Name (2'S,3'R,5'R)-2-[5-(Tert-butyldimethylsilyloxy)-1,3-dihydroxy-2-(phenylmethoxy)hexyl]-4,8-dimethoxy-1-naphthol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 556.285630285 u
Formula C31H44O7Si
InChI InChI=1S/C31H44O7Si/c1-20(38-39(7,8)31(2,3)4)17-24(32)30(37-19-21-13-10-9-11-14-21)29(34)23-18-26(36-6)22-15-12-16-25(35-5)27(22)28(23)33/h9-16,18,20,24,29-30,32-34H,17,19H2,1-8H3/t20-,24-,29?,30+/m1/s1
InChIKey IWVXPDUECGKEOP-RKEVWMKSSA-N
Molecular Weight 556.771 g/mol
SMILES C=1(C(=C2C(OC)=CC=CC2=C(C1)OC)O)C([C@@](OCC=1C=CC=CC1)([C@@](C[C@](O[Si](C(C)(C)C)(C)C)(C)[H])(O)[H])[H])O