John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=9N5MrHIJch4 SpectraBase Spectrum ID=GJucK5W8AKB

(accessed ).
STYLISSMIDE_E;CYCLO-(CIS-PRO-(1)-TYR-(2)-TRANS-PRO-(3)-ALA-(4)-ILE-(5)-GLN-(6)-ILE-(7))
SpectraBase Compound ID 9N5MrHIJch4
InChI InChI=1S/C39H58N8O9/c1-6-21(3)31-37(54)42-26(16-17-30(40)49)34(51)45-32(22(4)7-2)39(56)47-19-9-11-29(47)36(53)43-27(20-24-12-14-25(48)15-13-24)38(55)46-18-8-10-28(46)35(52)41-23(5)33(50)44-31/h12-15,21-23,26-29,31-32,48H,6-11,16-20H2,1-5H3,(H2,40,49)(H,41,52)(H,42,54)(H,43,53)(H,44,50)(H,45,51)/t21?,22?,23-,26-,27-,28-,29-,31-,32-/m0/s1
InChIKey ABLJJFBJJTYMSL-FOJMEVIISA-N
Mol Weight 782.9 g/mol
Molecular Formula C39H58N8O9
Exact Mass 782.432676 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GJucK5W8AKB
Name STYLISSMIDE_E;CYCLO-(CIS-PRO-(1)-TYR-(2)-TRANS-PRO-(3)-ALA-(4)-ILE-(5)-GLN-(6)-ILE-(7))
Compound Number 3
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H58N8O9
InChI InChI=1S/C39H58N8O9/c1-6-21(3)31-37(54)42-26(16-17-30(40)49)34(51)45-32(22(4)7-2)39(56)47-19-9-11-29(47)36(53)43-27(20-24-12-14-25(48)15-13-24)38(55)46-18-8-10-28(46)35(52)41-23(5)33(50)44-31/h12-15,21-23,26-29,31-32,48H,6-11,16-20H2,1-5H3,(H2,40,49)(H,41,52)(H,42,54)(H,43,53)(H,44,50)(H,45,51)/t21?,22?,23-,26-,27-,28-,29-,31-,32-/m0/s1
InChIKey ABLJJFBJJTYMSL-FOJMEVIISA-N
Literature Reference Author C.CYCHON,M.KOECK
Literature Reference Citation J.NAT.PROD.,73,738(2010)
Literature Reference DOI 10.1021/np900664f
Solvent DMSO-D6
Source File Reference UWMZ35378
SpectraBase Batch ID EGetWwRcxFy