John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=UnfZQiiOF7 SpectraBase Spectrum ID=1iSCk0bx39R

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TRICOLOROSIDE-METHYLESTER
SpectraBase Compound ID UnfZQiiOF7
InChI InChI=1S/C34H48O20/c1-5-13-14(16(29(44)46-3)10-48-31(13)53-33-27(42)25(40)23(38)19(8-35)51-33)7-21(37)50-18-6-15-17(30(45)47-4)11-49-32(22(15)12(18)2)54-34-28(43)26(41)24(39)20(9-36)52-34/h5,10-15,18-20,22-28,31-36,38-43H,1,6-9H2,2-4H3/t12-,13+,14-,15+,18-,19-,20-,22+,23-,24-,25+,26+,27-,28-,31-,32-,33+,34+/m0/s1
InChIKey SALKJJXIOWSSIF-HMOCMVIISA-N
Mol Weight 776.7 g/mol
Molecular Formula C34H48O20
Exact Mass 776.273895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1iSCk0bx39R
Name TRICOLOROSIDE-METHYLESTER
Compound Number 147
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H48O20
InChI InChI=1S/C34H48O20/c1-5-13-14(16(29(44)46-3)10-48-31(13)53-33-27(42)25(40)23(38)19(8-35)51-33)7-21(37)50-18-6-15-17(30(45)47-4)11-49-32(22(15)12(18)2)54-34-28(43)26(41)24(39)20(9-36)52-34/h5,10-15,18-20,22-28,31-36,38-43H,1,6-9H2,2-4H3/t12-,13+,14-,15+,18-,19-,20-,22+,23-,24-,25+,26+,27-,28-,31-,32-,33+,34+/m0/s1
InChIKey SALKJJXIOWSSIF-HMOCMVIISA-N
Literature Reference Author B.DINDA,S.DEBNATH,Y.HARIGAYA
Literature Reference Citation CHEM.PHARM.BULL.,55,689(2007)
Literature Reference DOI 10.1248/cpb.55.689
Molecular Weight 776.743 g/mol
Sample ID 37558
Solvent CD3OD
SpectraBase Batch ID A98Rny7BJak