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FELLUTANINE-C

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FELLUTANINE-C
SpectraBase Compound ID 8ZrsP0kQw8Y
InChI InChI=1S/C32H36N4O2/c1-7-31(3,4)27-21(19-13-9-11-15-23(19)33-27)17-25-29(37)36-26(30(38)35-25)18-22-20-14-10-12-16-24(20)34-28(22)32(5,6)8-2/h7-16,25-26,33-34H,1-2,17-18H2,3-6H3,(H,35,38)(H,36,37)/t25-,26+
InChIKey UHTOUBUBRNIMLK-WMPKNSHKSA-N
Mol Weight 508.7 g/mol
Molecular Formula C32H36N4O2
Exact Mass 508.283826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lLM5ie3fuX
Name (3S,6R)-3,6-bis[[2-(1,1-dimethylallyl)-1H-indol-3-yl]methyl]piperazine-2,5-dione
Alternate Name(s) (3S,6R)-3,6-bis[[2-(1,1-dimethylallyl)-1H-indol-3-yl]methyl]piperazine-2,5-quinone (3S,6R)-3,6-bis[[2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl]methyl]piperazine-2,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H36N4O2
InChI InChI=1S/C32H36N4O2/c1-7-31(3,4)27-21(19-13-9-11-15-23(19)33-27)17-25-29(37)36-26(30(38)35-25)18-22-20-14-10-12-16-24(20)34-28(22)32(5,6)8-2/h7-16,25-26,33-34H,1-2,17-18H2,3-6H3,(H,35,38)(H,36,37)/t25-,26+
InChIKey UHTOUBUBRNIMLK-WMPKNSHKSA-N
Molecular Weight 508.666 g/mol
SMILES [nH]1c2c(c(C[C@@]3(C(N[C@@](Cc4c([nH]c5c4cccc5)C(C=C)(C)C)(C(N3)=O)[H])=O)[H])c1C(C=C)(C)C)cccc2
SPLASH splash10-0002-0900020000-61cd185d227dd96b0351
Source of Spectrum G4-63-699-3
Wiley ID 1608427