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(2S,5R,6R)-2-[(2R,5R,6S)-5-Benzyloxy-5-ethyl-6-methyltetrahydropyran-2-yl]-6-(4-methoxybenzyloxy)heptan-2,5,7-triol
SpectraBase Compound ID 7wR4JGlcWXi
InChI InChI=1S/C30H44O7/c1-5-30(36-21-23-9-7-6-8-10-23)18-16-28(37-22(30)2)29(3,33)17-15-26(32)27(19-31)35-20-24-11-13-25(34-4)14-12-24/h6-14,22,26-28,31-33H,5,15-21H2,1-4H3/t22-,26+,27+,28+,29-,30+/m0/s1
InChIKey NNBMTTUPEPXZEV-MPQPIFTDSA-N
Mol Weight 516.7 g/mol
Molecular Formula C30H44O7
Exact Mass 516.308704 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEXk5ro4sCj
Name (2S,5R,6R)-2-[(2R,5R,6S)-5-Benzyloxy-5-ethyl-6-methyltetrahydropyran-2-yl]-6-(4-methoxybenzyloxy)heptan-2,5,7-triol
Alternate Name(s) 2-C-[(2R,5R,6S)-5-(benzyloxy)-5-ethyl-6-methyltetrahydro-2H-pyran-2-yl]-1,3,4-trideoxy-6-O-(4-methoxybenzyl)-D-xylo-heptitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H44O7
InChI InChI=1S/C30H44O7/c1-5-30(36-21-23-9-7-6-8-10-23)18-16-28(37-22(30)2)29(3,33)17-15-26(32)27(19-31)35-20-24-11-13-25(34-4)14-12-24/h6-14,22,26-28,31-33H,5,15-21H2,1-4H3/t22-,26+,27+,28+,29-,30+/m0/s1
InChIKey NNBMTTUPEPXZEV-MPQPIFTDSA-N
Molecular Weight 516.675 g/mol
SMILES OC[C@]([C@@](CC[C@@]([C@@]1(O[C@]([C@](OCc2ccccc2)(CC1)CC)(C)[H])[H])(O)C)(O)[H])(OCc1ccc(cc1)OC)[H]
SPLASH splash10-00di-4900000000-8631d3b81413001deece
Source of Spectrum E1-37-1715-0
Wiley ID 1517854