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2,3,6-TRI-O-ACETYL-4-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-BETA-D-1-THIOGLUCOPYRANOSIDE
SpectraBase Compound ID Bts46rINZQs
InChI InChI=1S/C26H36O17S/c1-10(27)34-8-17-19(36-12(3)29)21(37-13(4)30)23(39-15(6)32)25(41-17)43-20-18(9-35-11(2)28)42-26(44)24(40-16(7)33)22(20)38-14(5)31/h17-26,44H,8-9H2,1-7H3/t17-,18-,19+,20-,21+,22+,23-,24-,25+,26+/m1/s1
InChIKey CBJRSZGMIHOXAN-NDMRNNIMSA-N
Mol Weight 652.6 g/mol
Molecular Formula C26H36O17S
Exact Mass 652.167321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K8Wb9XrYxfT
Name 2,3,6-TRI-O-ACETYL-4-O-(2,3,4,6-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL)-BETA-D-1-THIOGLUCOPYRANOSIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H36O17S
InChI InChI=1S/C26H36O17S/c1-10(27)34-8-17-19(36-12(3)29)21(37-13(4)30)23(39-15(6)32)25(41-17)43-20-18(9-35-11(2)28)42-26(44)24(40-16(7)33)22(20)38-14(5)31/h17-26,44H,8-9H2,1-7H3/t17-,18-,19+,20-,21+,22+,23-,24-,25+,26+/m1/s1
InChIKey CBJRSZGMIHOXAN-NDMRNNIMSA-N
Literature Reference Author D.A.FULTON,J.F.STODDART
Literature Reference Citation J.ORG.CHEM.,66,8309(2001)
Literature Reference DOI 10.1021/jo010705z
Molecular Weight 652.622 g/mol
Solvent CDCl3
Source File Reference UWLU29068