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AYLWQQXQETWEBI-VWPRMMSESA-N
SpectraBase Compound ID 6Z0KVCAWamP
InChI InChI=1S/C44H48N8O11S2/c1-44(2,3)63-43(61)50-30(20-26-13-9-6-10-14-26)38(56)49-28-16-18-34-51(42(28)60)31(23-64-34)39(57)45-21-33(53)47-29(19-25-11-7-5-8-12-25)37(55)48-27-15-17-35-52(41(27)59)32(24-65-35)40(58)46-22-36(54)62-4/h5-18,29-32H,19-24H2,1-4H3,(H,45,57)(H,46,58)(H,47,53)(H,48,55)(H,49,56)(H,50,61)/t29-,30+,31-,32-/m1/s1
InChIKey AYLWQQXQETWEBI-VWPRMMSESA-N
Mol Weight 929.0 g/mol
Molecular Formula C44H48N8O11S2
Exact Mass 928.288397 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GG05kNSHmI7
Name AYLWQQXQETWEBI-VWPRMMSESA-N
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H48N8O11S2
InChI InChI=1S/C44H48N8O11S2/c1-44(2,3)63-43(61)50-30(20-26-13-9-6-10-14-26)38(56)49-28-16-18-34-51(42(28)60)31(23-64-34)39(57)45-21-33(53)47-29(19-25-11-7-5-8-12-25)37(55)48-27-15-17-35-52(41(27)59)32(24-65-35)40(58)46-22-36(54)62-4/h5-18,29-32H,19-24H2,1-4H3,(H,45,57)(H,46,58)(H,47,53)(H,48,55)(H,49,56)(H,50,61)/t29-,30+,31-,32-/m1/s1
InChIKey AYLWQQXQETWEBI-VWPRMMSESA-N
Literature Reference Author P.TREMMEL,A.GEYER
Literature Reference Citation EUR.J.ORG.CHEM.,3475(2005)
Molecular Weight 929.032 g/mol
Sample ID 30130
Solvent DMSO-D6