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Discarine X
SpectraBase Compound ID DVo5RYMBhnv
InChI InChI=1S/C33H43N5O4/c1-20(2)17-27-31(39)34-16-15-22-11-13-24(14-12-22)42-30(21(3)4)29(33(41)36-27)37-32(40)28(38(5)6)18-23-19-35-26-10-8-7-9-25(23)26/h7-16,19-21,27-30,35H,17-18H2,1-6H3,(H,34,39)(H,36,41)(H,37,40)/b16-15-
InChIKey QXLFGDAZDRFHAR-NXVVXOECSA-N
Mol Weight 573.7 g/mol
Molecular Formula C33H43N5O4
Exact Mass 573.331505 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IEdJLuYJ5Bb
Name DISCARINE-X
CAS Registry Number 164577-53-1
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C33H43N5O4
InChI InChI=1S/C33H43N5O4/c1-20(2)17-27-31(39)34-16-15-22-11-13-24(14-12-22)42-30(21(3)4)29(33(41)36-27)37-32(40)28(38(5)6)18-23-19-35-26-10-8-7-9-25(23)26/h7-16,19-21,27-30,35H,17-18H2,1-6H3,(H,34,39)(H,36,41)(H,37,40)/b16-15-
InChIKey QXLFGDAZDRFHAR-NXVVXOECSA-N
Literature Reference Author E.C.MACHADO,A.A.FILHO,A.F.MOREL,F.D.MONACHE
Literature Reference Citation J.NAT.PROD.,58,548(1995)
Literature Reference DOI 10.1021/np50118a010
Molecular Weight 573.736 g/mol
Solvent CDCl3
Source File Reference UWSK83