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N-(4-Benzoylphenyl)-2-[(2,3,4,6-tetra-O-acetyl-5-thiohexopyranosyl)oxy]acetamide
SpectraBase Compound ID F8505c2n902
InChI InChI=1S/C29H31NO11S/c1-16(31)37-14-23-26(39-17(2)32)27(40-18(3)33)28(41-19(4)34)29(42-23)38-15-24(35)30-22-12-10-21(11-13-22)25(36)20-8-6-5-7-9-20/h5-13,23,26-29H,14-15H2,1-4H3,(H,30,35)
InChIKey BJTJQGSNQJAQHI-UHFFFAOYSA-N
Mol Weight 601.62 g/mol
Molecular Formula C29H31NO11S
Exact Mass 601.161782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ed6RW6hEmJQ
Name N-(4-Benzoylphenyl)-2-[(2,3,4,6-tetra-O-acetyl-5-thiohexopyranosyl)oxy]acetamide
CAS Registry Number 73364-62-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H31NO11S
InChI InChI=1S/C29H31NO11S/c1-16(31)37-14-23-26(39-17(2)32)27(40-18(3)33)28(41-19(4)34)29(42-23)38-15-24(35)30-22-12-10-21(11-13-22)25(36)20-8-6-5-7-9-20/h5-13,23,26-29H,14-15H2,1-4H3,(H,30,35)
InChIKey BJTJQGSNQJAQHI-UHFFFAOYSA-N
Molecular Weight 601.623 g/mol
SMILES N(c1ccc(cc1)C(c1ccccc1)=O)C(COC1C(C(C(C(COC(C)=O)S1)OC(C)=O)OC(C)=O)OC(C)=O)=O
SPLASH splash10-0005-4692100000-b23c0ea3ce0dd83f291a
Source of Spectrum I-59-2938-0
Synonyms (4-Benzoylphenyl)aminocarbonylmethyl 2,3,4,6-tetra-O-acetyl-1-thio-.alpha.-D-glucopyranoside 2,3,4,6-Tetra-O-acetyl-(4-acetamidobenzophenone)-1-thio-.alpha.-D-glucopyranoside [3,4,5-triacetoxy-6-[2-(4-benzoylanilino)-2-oxo-ethoxy]tetrahydrothiopyran-2-yl]methyl acetate [3,4,5-triacetyloxy-6-[2-(4-benzoylanilino)-2-oxoethoxy]thian-2-yl]methyl acetate [3,4,5-triacetyloxy-6-[2-oxidanylidene-2-[[4-(phenylcarbonyl)phenyl]amino]ethoxy]thian-2-yl]methyl ethanoate Acetic acid [3,4,5-triacetyloxy-6-[2-(4-benzoylanilino)-2-oxoethoxy]-2-thianyl]methyl ester
Wiley ID 1410225