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Ulithiacyclamide B
SpectraBase Compound ID JIGac8xPQjX
InChI InChI=1S/C35H40N8O6S4/c1-16(2)10-20-34-40-22(12-50-34)28(44)38-25-15-53-52-14-24(32-42-26(17(3)48-32)30(46)36-20)39-29(45)23-13-51-35(41-23)21(11-19-8-6-5-7-9-19)37-31(47)27-18(4)49-33(25)43-27/h5-9,12-13,16-18,20-21,24-27H,10-11,14-15H2,1-4H3,(H,36,46)(H,37,47)(H,38,44)(H,39,45)/t17-,18-,20-,21-,24-,25-,26+,27+/m1/s1
InChIKey ALXRBWFBPYGRNS-CIQZLZIBSA-N
Mol Weight 797.0 g/mol
Molecular Formula C35H40N8O6S4
Exact Mass 796.195366 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HZ539EJQi57
Name ULITHIACYCLAMIDE-B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C35H40N8O6S4
InChI InChI=1S/C35H40N8O6S4/c1-16(2)10-20-34-40-22(12-50-34)28(44)38-25-15-53-52-14-24(32-42-26(17(3)48-32)30(46)36-20)39-29(45)23-13-51-35(41-23)21(11-19-8-6-5-7-9-19)37-31(47)27-18(4)49-33(25)43-27/h5-9,12-13,16-18,20-21,24-27H,10-11,14-15H2,1-4H3,(H,36,46)(H,37,47)(H,38,44)(H,39,45)/t17-,18-,20-,21-,24-,25-,26+,27+/m1/s1
InChIKey ALXRBWFBPYGRNS-CIQZLZIBSA-N
Literature Reference Author D.E.WILLIAMS,R.E.MOORE,V.J.PAUL
Literature Reference Citation J.NAT.PROD.,52,732(1989)
Literature Reference DOI 10.1021/np50064a011
Molecular Weight 796.993 g/mol
Solvent CDCl3
Source File Reference UWTS91