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JBIR-57

View entire compound with spectra: 1 NMR

JBIR-57
SpectraBase Compound ID 1PMlPRRTtgs
InChI InChI=1S/C18H28N4O5/c1-8(2)7-12(15(23)20-11(6)18(26)27)21-17(25)14-10(5)19-16(24)13(22-14)9(3)4/h8-9,11-12H,7H2,1-6H3,(H,19,24)(H,20,23)(H,21,25)(H,26,27)/t11-,12+/m0/s1
InChIKey UWRBCOGQVDTYGV-NWDGAFQWSA-N
Mol Weight 380.45 g/mol
Molecular Formula C18H28N4O5
Exact Mass 380.20597 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LZAEdZGeeBK
Name JBIR-57
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H28N4O5
InChI InChI=1S/C18H28N4O5/c1-8(2)7-12(15(23)20-11(6)18(26)27)21-17(25)14-10(5)19-16(24)13(22-14)9(3)4/h8-9,11-12H,7H2,1-6H3,(H,19,24)(H,20,23)(H,21,25)(H,26,27)/t11-,12+/m0/s1
InChIKey UWRBCOGQVDTYGV-NWDGAFQWSA-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 380.444 g/mol
Sample ID 39051
Solvent DMSO-D6