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O-ETHYL-4-[(2',3',4'-TRI-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYLOXY)-BENZYL]-THIOCARBAMATE-(Z)
SpectraBase Compound ID 8ZiU4xi9fzp
InChI InChI=1S/2C22H29NO9S/c2*1-6-27-22(33)23-11-16-7-9-17(10-8-16)32-21-20(31-15(5)26)19(30-14(4)25)18(12(2)28-21)29-13(3)24/h2*7-10,12,18-21H,6,11H2,1-5H3,(H,23,33)/t2*12-,18-,19+,20+,21-/m00/s1
InChIKey MCWQATXXCKOYCL-OPIJCOBBSA-N
Mol Weight 967.06 g/mol
Molecular Formula C44H58N2O18S2
Exact Mass 966.312605 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5jwRo1C9wrt
Name O-ETHYL-4-[(2',3',4'-TRI-O-ACETYL-ALPHA-L-RHAMNOPYRANOSYLOXY)-BENZYL]-THIOCARBAMATE-(Z)
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H58N2O18S2
InChI InChI=1S/2C22H29NO9S/c2*1-6-27-22(33)23-11-16-7-9-17(10-8-16)32-21-20(31-15(5)26)19(30-14(4)25)18(12(2)28-21)29-13(3)24/h2*7-10,12,18-21H,6,11H2,1-5H3,(H,23,33)/t2*12-,18-,19+,20+,21-/m00/s1
InChIKey MCWQATXXCKOYCL-OPIJCOBBSA-N
Literature Reference Author S.FAIZI,B.S.SIDDIQUI,R.SALEEM,S.SIDDIQUI,K.AFTAB,A.U.H.GILAN I
Literature Reference Citation PHYTOCHEM.,38,957(1995)
Literature Reference DOI 10.1016/0031-9422(94)00729-D
Molecular Weight 967.067 g/mol
Solvent DMSO-D6
Source File Reference UWMS3821