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2-(2',3',4'-Tri-O-benzoyl-.beta.D-glucopyranosyl)amino-2-thiazoline
SpectraBase Compound ID C2o5r9EJDrE
InChI InChI=1S/C30H28N2O8S/c33-18-22-23(38-27(34)19-10-4-1-5-11-19)24(39-28(35)20-12-6-2-7-13-20)25(26(37-22)32-30-31-16-17-41-30)40-29(36)21-14-8-3-9-15-21/h1-15,22-26,33H,16-18H2,(H,31,32)/t22-,23-,24+,25-,26-/m1/s1
InChIKey ILUFYMIFQPFTPX-WSGIOKLISA-N
Mol Weight 576.62 g/mol
Molecular Formula C30H28N2O8S
Exact Mass 576.156637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID vx3TrBZsRn
Name 2-(2',3',4'-Tri-O-benzoyl-.beta.D-glucopyranosyl)amino-2-thiazoline
Alternate Name(s) 2,3,4-tri-O-benzoyl-N-(4,5-dihydro-1,3-thiazol-2-yl)hexopyranosylamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H28N2O8S
InChI InChI=1S/C30H28N2O8S/c33-18-22-23(38-27(34)19-10-4-1-5-11-19)24(39-28(35)20-12-6-2-7-13-20)25(26(37-22)32-30-31-16-17-41-30)40-29(36)21-14-8-3-9-15-21/h1-15,22-26,33H,16-18H2,(H,31,32)/t22-,23-,24+,25-,26-/m1/s1
InChIKey ILUFYMIFQPFTPX-WSGIOKLISA-N
Molecular Weight 576.620 g/mol
SMILES N([C@@]1(O[C@](CO)([C@]([C@@]([C@]1(OC(=O)c1ccccc1)[H])(OC(=O)c1ccccc1)[H])(OC(=O)c1ccccc1)[H])[H])[H])C1=NCCS1
SPLASH splash10-0adi-3900000000-aafd4039e989ab5b8f2c
Source of Spectrum F-48-6422-10
Wiley ID 1408190