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EPI-AGELASINE-C
SpectraBase Compound ID AzoJLreowNl
InChI InChI=1S/C26H40N5/c1-18(12-15-31-17-30(6)24-22(31)23(27)28-16-29-24)11-14-26(5)19(2)9-10-20-21(26)8-7-13-25(20,3)4/h8,12,16-17,19-20H,7,9-11,13-15H2,1-6H3,(H2,27,28,29)/q+1/b18-12+/t19-,20+,26+/m0/s1
InChIKey AGTCBVBMJBPVIF-LMIWPFHYSA-N
Mol Weight 422.6 g/mol
Molecular Formula C26H40N5
Exact Mass 422.328371 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JjBINgMHUlV
Name EPI-AGELASINE-C
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H40N5
InChI InChI=1S/C26H40N5/c1-18(12-15-31-17-30(6)24-22(31)23(27)28-16-29-24)11-14-26(5)19(2)9-10-20-21(26)8-7-13-25(20,3)4/h8,12,16-17,19-20H,7,9-11,13-15H2,1-6H3,(H2,27,28,29)/q+1/b18-12+/t19-,20+,26+/m0/s1
InChIKey AGTCBVBMJBPVIF-LMIWPFHYSA-N
Literature Reference Author T.HATTORI,K.ADACHI,Y.SHIZURI
Literature Reference Citation J.NAT.PROD.,60,411(1997)
Literature Reference DOI 10.1021/np960745b
Molecular Weight 422.637 g/mol
Solvent DMSO-D6
Source File Reference UWCP136