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N-(1,3,4,6,7-Penta-O-acetyl-2-deoxy-B-D-glycero-L-gluco-hepto-py-2-Y L)-N'-(2,3,4,6-tetra-O-acetyl-B-D-gluco-py)-thiourea
SpectraBase Compound ID 2Dxxps7rNIZ
InChI InChI=1S/C32H44N2O20S/c1-12(35)44-10-21(46-14(3)37)25-27(49-17(6)40)26(48-16(5)39)23(31(54-25)52-20(9)43)33-32(55)34-30-29(51-19(8)42)28(50-18(7)41)24(47-15(4)38)22(53-30)11-45-13(2)36/h21-31H,10-11H2,1-9H3,(H2,33,34,55)
InChIKey XWCWVEMWLJFPSJ-UHFFFAOYSA-N
Mol Weight 808.8 g/mol
Molecular Formula C32H44N2O20S
Exact Mass 808.220813 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H9WgAf6PvMy
Name N-(1,3,4,6,7-Penta-O-acetyl-2-deoxy-B-D-glycero-L-gluco-hepto-py-2-Y L)-N'-(2,3,4,6-tetra-O-acetyl-B-D-gluco-py)-thiourea
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Formula C32H44N2O20S
InChI InChI=1S/C32H44N2O20S/c1-12(35)44-10-21(46-14(3)37)25-27(49-17(6)40)26(48-16(5)39)23(31(54-25)52-20(9)43)33-32(55)34-30-29(51-19(8)42)28(50-18(7)41)24(47-15(4)38)22(53-30)11-45-13(2)36/h21-31H,10-11H2,1-9H3,(H2,33,34,55)
InChIKey XWCWVEMWLJFPSJ-UHFFFAOYSA-N
Instrument Name RMU
Literature Reference M. Avalos, R. Babiano, P. Cintas, J. Chem. Soc. Perkin I 495 (1990).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3