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(N-TERT.-BUTYLCARBONYL)-SUBEREDAMINE_B
SpectraBase Compound ID KHDmLq8kq3c
InChI InChI=1S/C29H40Br3N3O5/c1-29(2,3)40-28(37)35(6)24(18-19-9-10-25(38-7)21(30)15-19)27(36)33-12-11-20-16-22(31)26(23(32)17-20)39-14-8-13-34(4)5/h9-10,15-17,24H,8,11-14,18H2,1-7H3,(H,33,36)/t24-/m0/s1
InChIKey VUZSKMXWUUTKCO-DEOSSOPVSA-N
Mol Weight 750.4 g/mol
Molecular Formula C29H40Br3N3O5
Exact Mass 747.05181 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4wkxnVrysHP
Name (N-TERT.-BUTYLCARBONYL)-SUBEREDAMINE_B
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H40Br3N3O5
InChI InChI=1S/C29H40Br3N3O5/c1-29(2,3)40-28(37)35(6)24(18-19-9-10-25(38-7)21(30)15-19)27(36)33-12-11-20-16-22(31)26(23(32)17-20)39-14-8-13-34(4)5/h9-10,15-17,24H,8,11-14,18H2,1-7H3,(H,33,36)/t24-/m0/s1
InChIKey VUZSKMXWUUTKCO-DEOSSOPVSA-N
Literature Reference Author S.K.KOTTAKOTA,D.EVANGELOPOULOS,A.ALNIMR,S.BHAKTA,T.D.MCHUGH, M.GRAY,P.W.GROUNDWAT
Literature Reference Citation J.NAT.PROD.,75,1090(2012)
Literature Reference DOI 10.1021/np300102z
Molecular Weight 750.366 g/mol
Sample ID 41127
Solvent CDCl3