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.beta.-D-Glucopyranoside, cyclohexyl 2-deoxy-2-[(3-methyl-1-oxobutyl)amino]-4,6-O-(phenylmethylene)-, 3-benzenepropanoate
SpectraBase Compound ID ITenQtYXnu3
InChI InChI=1S/C33H43NO7/c1-22(2)20-27(35)34-31-29(37)30-26(21-38-32(39-30)24-14-8-4-9-15-24)40-33(31,25-16-10-5-11-17-25)41-28(36)19-18-23-12-6-3-7-13-23/h3-4,6-9,12-15,22,25-26,29-32,37H,5,10-11,16-21H2,1-2H3,(H,34,35)/t26-,29+,30-,31-,32?,33+/m1/s1
InChIKey XWNMJUZRNKIRMJ-FMXOWTOLSA-N
Mol Weight 565.7 g/mol
Molecular Formula C33H43NO7
Exact Mass 565.303953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7XU2EEEu6gg
Name .beta.-D-Glucopyranoside, cyclohexyl 2-deoxy-2-[(3-methyl-1-oxobutyl)amino]-4,6-O-(phenylmethylene)-, 3-benzenepropanoate
CAS Registry Number 79284-62-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H43NO7
InChI InChI=1S/C33H43NO7/c1-22(2)20-27(35)34-31-29(37)30-26(21-38-32(39-30)24-14-8-4-9-15-24)40-33(31,25-16-10-5-11-17-25)41-28(36)19-18-23-12-6-3-7-13-23/h3-4,6-9,12-15,22,25-26,29-32,37H,5,10-11,16-21H2,1-2H3,(H,34,35)/t26-,29+,30-,31-,32?,33+/m1/s1
InChIKey XWNMJUZRNKIRMJ-FMXOWTOLSA-N
Molecular Weight 565.707 g/mol
SMILES O[C@]1([C@]2([C@](O[C@]([C@@]1(NC(=O)CC(C)C)[H])(OC(=O)CCc1ccccc1)C1CCCCC1)(COC(O2)c1ccccc1)[H])[H])[H]
SPLASH splash10-0a4i-4901100000-f7511d0d0ca43ee8ed94
Source of Spectrum F-37-1890-0
Synonyms 4,6-O-benzylidene-1-C-cyclohexyl-2-deoxy-2-[(3-methylbutanoyl)amino]-1-O-(3-phenylpropanoyl)-.beta.-D-glucopyranose Cyclohexyl 4,6-O-benzylidene-2-deoxy-(3-methyl-1-oxobutyl)amino-3-O-(1-oxo-3-phenylpropyl)-.beta.-D-glucopyranoside Pyrano[3,2-d]-1,3-dioxin, .beta.-D-glucopyranoside deriv.
Wiley ID 1407239