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N-1-[(E)-stilbenyloxy]ethylcarbonyltryptophan
SpectraBase Compound ID L792iOUYzo6
InChI InChI=1S/C28H26N2O4/c1-19(34-26(21-12-6-3-7-13-21)16-20-10-4-2-5-11-20)27(31)30-25(28(32)33)17-22-18-29-24-15-9-8-14-23(22)24/h2-16,18-19,25,29H,17H2,1H3,(H,30,31)(H,32,33)/b26-16+/t19?,25-/m0/s1
InChIKey AZAQQGKAPSBFHZ-FGJVDKHYSA-N
Mol Weight 454.53 g/mol
Molecular Formula C28H26N2O4
Exact Mass 454.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID TiM97j464K
Name N-1-[(E)-stilbenyloxy]ethylcarbonyltryptophan
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H26N2O4
InChI InChI=1S/C28H26N2O4/c1-19(34-26(21-12-6-3-7-13-21)16-20-10-4-2-5-11-20)27(31)30-25(28(32)33)17-22-18-29-24-15-9-8-14-23(22)24/h2-16,18-19,25,29H,17H2,1H3,(H,30,31)(H,32,33)/b26-16+/t19?,25-/m0/s1
InChIKey AZAQQGKAPSBFHZ-FGJVDKHYSA-N
Molecular Weight 454.526 g/mol
SMILES [nH]1c2c(c(C[C@@](C(=O)O)(NC(C(O\C(=C\c3ccccc3)c3ccccc3)C)=O)[H])c1)cccc2
SPLASH splash10-001i-0910100000-f88987623f1f916c171b
Source of Spectrum O-29-347-0
Synonyms (2S)-2-[(2-{[(E)-1,2-diphenylethenyl]oxy}propanoyl)amino]-3-(1H-indol-3-yl)propanoic acid
Wiley ID 1388841