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

*Links on SpectraBase are not permalinks.
CYCLOLINOPEPTIDE-G;CYCLO-(PRO-PHE-PHE-TRP-ILE-MSO-LEU-MSO)
SpectraBase Compound ID KxHwRJOWgqJ
InChI InChI=1S/C56H75N9O10S2/c1-7-35(4)48-55(72)58-41(24-27-76(5)74)49(66)60-43(29-34(2)3)50(67)59-42(25-28-77(6)75)56(73)65-26-16-23-47(65)54(71)63-45(31-37-19-12-9-13-20-37)52(69)61-44(30-36-17-10-8-11-18-36)51(68)62-46(53(70)64-48)32-38-33-57-40-22-15-14-21-39(38)40/h8-15,17-22,33-35,41-48,57H,7,16,23-32H2,1-6H3,(H,58,72)(H,59,67)(H,60,66)(H,61,69)(H,62,68)(H,63,71)(H,64,70)/t35?,41-,42-,43+,44-,45+,46+,47-,48-,76?,77?/m1/s1
InChIKey MGTCVHJATWUGDT-IJYZKCMGSA-N
Mol Weight 1098.4 g/mol
Molecular Formula C56H75N9O10S2
Exact Mass 1097.507832 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 5nJO5vlkOmD
Name CYCLOLINOPEPTIDE-G;CYCLO-(PRO-PHE-PHE-TRP-ILE-MSO-LEU-MSO)
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H75N9O10S2
InChI InChI=1S/C56H75N9O10S2/c1-7-35(4)48-55(72)58-41(24-27-76(5)74)49(66)60-43(29-34(2)3)50(67)59-42(25-28-77(6)75)56(73)65-26-16-23-47(65)54(71)63-45(31-37-19-12-9-13-20-37)52(69)61-44(30-36-17-10-8-11-18-36)51(68)62-46(53(70)64-48)32-38-33-57-40-22-15-14-21-39(38)40/h8-15,17-22,33-35,41-48,57H,7,16,23-32H2,1-6H3,(H,58,72)(H,59,67)(H,60,66)(H,61,69)(H,62,68)(H,63,71)(H,64,70)/t35?,41-,42-,43+,44-,45+,46+,47-,48-,76?,77?/m1/s1
InChIKey MGTCVHJATWUGDT-IJYZKCMGSA-N
Literature Reference Author T.MATSUMOTO,A.SHISHIDO,H.MORITA,H.ITOKAWA,K.TAKEYA
Literature Reference Citation PHYTOCHEM.,57,251(2001)
Literature Reference DOI 10.1016/S0031-9422(00)00442-8
Molecular Weight 1098.386 g/mol
Solvent DMSO-D6
Source File Reference UWVN2146