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JBIR-56;SYNTHETIC

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JBIR-56;SYNTHETIC
SpectraBase Compound ID LElLt8YEMHV
InChI InChI=1S/C19H30N4O5/c1-7-12-15(23-14(10(4)5)17(25)21-12)18(26)22-13(8-9(2)3)16(24)20-11(6)19(27)28/h9-11,13H,7-8H2,1-6H3,(H,20,24)(H,21,25)(H,22,26)(H,27,28)/t11-,13+/m0/s1
InChIKey XNVDHFYDNXAOFB-WCQYABFASA-N
Mol Weight 394.47 g/mol
Molecular Formula C19H30N4O5
Exact Mass 394.22162 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8HwFlzZ2xwl
Name JBIR-56;ISOLATED
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H30N4O5
InChI InChI=1S/C19H30N4O5/c1-7-12-15(23-14(10(4)5)17(25)21-12)18(26)22-13(8-9(2)3)16(24)20-11(6)19(27)28/h9-11,13H,7-8H2,1-6H3,(H,20,24)(H,21,25)(H,22,26)(H,27,28)/t11-,13+/m0/s1
InChIKey XNVDHFYDNXAOFB-WCQYABFASA-N
Literature Reference Author K.MOTOHASHI,K.INABA,S.FUSE,T.DOI,M.IZUMIKAWA,S.T.KHAN,M.TAKA GI,T.TAKAHASHI,K.SHI
Literature Reference Citation J.NAT.PROD.,74,1630(2011)
Literature Reference DOI 10.1021/np200386c
Molecular Weight 394.471 g/mol
Sample ID 39049
Solvent DMSO-D6