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(2S,3R,5R)-3-AZIDO-2-BENZOYLOXY-5-(2'-DEOXY-2'-PHTHALIMIDO-3',4',6'-TRI-O-ACETAL-ALPHA-D-GLUCOPYRANOSYLOXY)-CYCLOHEXANONE-ETHYLENE-DITHIACETAL

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(2S,3R,5R)-3-AZIDO-2-BENZOYLOXY-5-(2'-DEOXY-2'-PHTHALIMIDO-3',4',6'-TRI-O-ACETAL-ALPHA-D-GLUCOPYRANOSYLOXY)-CYCLOHEXANONE-ETHYLENE-DITHIACETAL
SpectraBase Compound ID HRVZTmlMAHH
InChI InChI=1S/C35H36N4O12S2/c1-18(40)46-17-26-28(47-19(2)41)29(48-20(3)42)27(39-31(43)23-11-7-8-12-24(23)32(39)44)34(50-26)49-22-15-25(37-38-36)30(35(16-22)52-13-14-53-35)51-33(45)21-9-5-4-6-10-21/h4-12,22,25-30,34H,13-17H2,1-3H3/t22-,25-,26-,27-,28-,29-,30+,34+/m0/s1
InChIKey RTRISNDARNMHHK-DELGHDGDSA-N
Mol Weight 768.8 g/mol
Molecular Formula C35H36N4O12S2
Exact Mass 768.177115 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HkwZyi2rWWp
Name (2S,3R,5R)-3-AZIDO-2-BENZOYLOXY-5-(2'-DEOXY-2'-PHTHALIMIDO-3',4',6'-TRI-O-ACETAL-ALPHA-D-GLUCOPYRANOSYLOXY)-CYCLOHEXANONE-ETHYLENE-DITHIACETAL
Compound Number 24
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H36N4O12S2
InChI InChI=1S/C35H36N4O12S2/c1-18(40)46-17-26-28(47-19(2)41)29(48-20(3)42)27(39-31(43)23-11-7-8-12-24(23)32(39)44)34(50-26)49-22-15-25(37-38-36)30(35(16-22)52-13-14-53-35)51-33(45)21-9-5-4-6-10-21/h4-12,22,25-30,34H,13-17H2,1-3H3/t22-,25-,26-,27-,28-,29-,30+,34+/m0/s1
InChIKey RTRISNDARNMHHK-DELGHDGDSA-N
Literature Reference Author I.F.PELYVAS,M.MADI-PUSKAS,Z.G.TOTH,Z.VARGA,M.HORNYAK,G.BATTA ,F.SZTARICSKAI
Literature Reference Citation J.ANTIBIOTICS,48,683(1995)
Literature Reference DOI 10.7164/antibiotics.48.683
Molecular Weight 768.810 g/mol
Solvent ACETONE-D6