For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

CJVSIFYBIXLTOM-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

CJVSIFYBIXLTOM-UHFFFAOYSA-N
SpectraBase Compound ID 8auUrwpJCUk
InChI InChI=1S/C48H84N6O16S2/c1-43(2,3)65-35(57)25-53(19)37(59)31(49-33(55)23-21-29(39(61)67-45(7,8)9)51-41(63)69-47(13,14)15)27-71-72-28-32(38(60)54(20)26-36(58)66-44(4,5)6)50-34(56)24-22-30(40(62)68-46(10,11)12)52-42(64)70-48(16,17)18/h29-32H,21-28H2,1-20H3,(H,49,55)(H,50,56)(H,51,63)(H,52,64)
InChIKey CJVSIFYBIXLTOM-UHFFFAOYSA-N
Mol Weight 1065.3 g/mol
Molecular Formula C48H84N6O16S2
Exact Mass 1064.538523 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BHrt5QKEGWN
Name CJVSIFYBIXLTOM-UHFFFAOYSA-N
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H84N6O16S2
InChI InChI=1S/C48H84N6O16S2/c1-43(2,3)65-35(57)25-53(19)37(59)31(49-33(55)23-21-29(39(61)67-45(7,8)9)51-41(63)69-47(13,14)15)27-71-72-28-32(38(60)54(20)26-36(58)66-44(4,5)6)50-34(56)24-22-30(40(62)68-46(10,11)12)52-42(64)70-48(16,17)18/h29-32H,21-28H2,1-20H3,(H,49,55)(H,50,56)(H,51,63)(H,52,64)
InChIKey CJVSIFYBIXLTOM-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 1065.346 g/mol
Solvent CDCl3
Source File Reference UWLU31207