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RGGMEYFNZFWBND-UHFFFAOYSA-N
SpectraBase Compound ID 3HTZyEY3oVQ
InChI InChI=1S/C31H56N4O10S/c1-20(36)33-19-46-18-22(24(38)32-17-23(37)42-28(2,3)4)35(27(41)45-31(11,12)13)16-14-15-21(25(39)43-29(5,6)7)34-26(40)44-30(8,9)10/h21-22H,14-19H2,1-13H3,(H,32,38)(H,33,36)(H,34,40)
InChIKey RGGMEYFNZFWBND-UHFFFAOYSA-N
Mol Weight 676.9 g/mol
Molecular Formula C31H56N4O10S
Exact Mass 676.371715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CA56KPFTwCY
Name RGGMEYFNZFWBND-UHFFFAOYSA-N
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H56N4O10S
InChI InChI=1S/C31H56N4O10S/c1-20(36)33-19-46-18-22(24(38)32-17-23(37)42-28(2,3)4)35(27(41)45-31(11,12)13)16-14-15-21(25(39)43-29(5,6)7)34-26(40)44-30(8,9)10/h21-22H,14-19H2,1-13H3,(H,32,38)(H,33,36)(H,34,40)
InChIKey RGGMEYFNZFWBND-UHFFFAOYSA-N
Literature Reference Author D.BURG,D.V.FILIPPOV,R.HERMANNS,G.A.V.D.MAREL,J.H.V.BOOM,G.J. MULDER
Literature Reference Citation BIOORG.MED.CHEM.,10,195(2002)
Literature Reference DOI 10.1016/S0968-0896(01)00269-3
Molecular Weight 676.866 g/mol
Solvent CDCl3:CD3OD
Source File Reference UWLU31214