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4-(3-ETHOXY-4-HYDROXPHENYL)-6-(1,2,3,4-TETRAHYDRONAPHTHALEN-6-YL)-2-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYLTHIO)-PYRIDINE-3-CARBONITRILE

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4-(3-ETHOXY-4-HYDROXPHENYL)-6-(1,2,3,4-TETRAHYDRONAPHTHALEN-6-YL)-2-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYLTHIO)-PYRIDINE-3-CARBONITRILE
SpectraBase Compound ID 7O0FbC31IQi
InChI InChI=1S/C38H40N2O11S/c1-6-46-32-16-26(13-14-31(32)45)28-17-30(27-12-11-24-9-7-8-10-25(24)15-27)40-37(29(28)18-39)52-38-36(50-23(5)44)35(49-22(4)43)34(48-21(3)42)33(51-38)19-47-20(2)41/h11-17,33-36,38,45H,6-10,19H2,1-5H3/t33-,34-,35+,36-,38+/m1/s1
InChIKey ISRXJJYYHPBBBL-DJCHGSEYSA-N
Mol Weight 732.8 g/mol
Molecular Formula C38H40N2O11S
Exact Mass 732.235281 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CJ7os1J8GlA
Name 4-(3-ETHOXY-4-HYDROXPHENYL)-6-(1,2,3,4-TETRAHYDRONAPHTHALEN-6-YL)-2-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYLTHIO)-PYRIDINE-3-CARBONITRILE
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H40N2O11S
InChI InChI=1S/C38H40N2O11S/c1-6-46-32-16-26(13-14-31(32)45)28-17-30(27-12-11-24-9-7-8-10-25(24)15-27)40-37(29(28)18-39)52-38-36(50-23(5)44)35(49-22(4)43)34(48-21(3)42)33(51-38)19-47-20(2)41/h11-17,33-36,38,45H,6-10,19H2,1-5H3/t33-,34-,35+,36-,38+/m1/s1
InChIKey ISRXJJYYHPBBBL-DJCHGSEYSA-N
Literature Reference Author M.S.A.MUTAIRI,E.S.A.ABDULLAH,M.E.HAIBA,M.A.KHEDR,W.A.ZAGHARY
Literature Reference Citation MOLECULES,17,4717(2012)
Literature Reference DOI 10.3390/molecules17044717
Molecular Weight 732.802 g/mol
Sample ID 1760
Solvent DMSO-D6