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Butyl 2-([2-(acetylamino)-3-(1H-indol-3-yl)propanoyl]amino)-3-(1H-indol-3-yl)propanoate
SpectraBase Compound ID BTZuGsupadL
InChI InChI=1S/C28H32N4O4/c1-3-4-13-36-28(35)26(15-20-17-30-24-12-8-6-10-22(20)24)32-27(34)25(31-18(2)33)14-19-16-29-23-11-7-5-9-21(19)23/h5-12,16-17,25-26,29-30H,3-4,13-15H2,1-2H3,(H,31,33)(H,32,34)
InChIKey NUQPOXLFIVIBHF-UHFFFAOYSA-N
Mol Weight 488.6 g/mol
Molecular Formula C28H32N4O4
Exact Mass 488.242356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2GYl00f8aUq
Name Butyl 2-([2-(acetylamino)-3-(1H-indol-3-yl)propanoyl]amino)-3-(1H-indol-3-yl)propanoate
CAS Registry Number 77536-43-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H32N4O4
InChI InChI=1S/C28H32N4O4/c1-3-4-13-36-28(35)26(15-20-17-30-24-12-8-6-10-22(20)24)32-27(34)25(31-18(2)33)14-19-16-29-23-11-7-5-9-21(19)23/h5-12,16-17,25-26,29-30H,3-4,13-15H2,1-2H3,(H,31,33)(H,32,34)
InChIKey NUQPOXLFIVIBHF-UHFFFAOYSA-N
Molecular Weight 488.588 g/mol
SMILES [nH]1c2ccccc2c(CC(C(=O)OCCCC)NC(C(Cc2c[nH]c3ccccc23)NC(C)=O)=O)c1
SPLASH splash10-001i-0910000000-6f3ca64a86162b9de91d
Source of Spectrum W5-0-0-0
Synonyms 2-[[2-acetamido-3-(1H-indol-3-yl)-1-oxopropyl]amino]-3-(1H-indol-3-yl)propanoic acid butyl ester 2-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propionic acid butyl ester Butyl 2-[[2-acetamido-3-(1H-indol-3-yl)propanoyl]amino]-3-(1H-indol-3-yl)propanoate L-Tryptophan, N-(N-acetyl-L-tryptophyl)-, butyl ester
Wiley ID 1396909