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(S)-N-Acetyl-O-[5-[2-[(acetyl)amino]-2-(methoxycarbonyl)ethyl]-2-methoxyphenyl]-L-tyrosine Methyl ester
SpectraBase Compound ID LjI1hG4xu4Q
InChI InChI=1S/C25H30N2O8/c1-15(28)26-20(24(30)33-4)12-17-6-9-19(10-7-17)35-23-14-18(8-11-22(23)32-3)13-21(25(31)34-5)27-16(2)29/h6-11,14,20-21H,12-13H2,1-5H3,(H,26,28)(H,27,29)/t20-,21-/m0/s1
InChIKey RBXKJZLPVSNMPR-SFTDATJTSA-N
Mol Weight 486.52 g/mol
Molecular Formula C25H30N2O8
Exact Mass 486.200216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JlDJui3Adxf
Name (S)-N-Acetyl-O-[5-[2-[(acetyl)amino]-2-(methoxycarbonyl)ethyl]-2-methoxyphenyl]-L-tyrosine Methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30N2O8
InChI InChI=1S/C25H30N2O8/c1-15(28)26-20(24(30)33-4)12-17-6-9-19(10-7-17)35-23-14-18(8-11-22(23)32-3)13-21(25(31)34-5)27-16(2)29/h6-11,14,20-21H,12-13H2,1-5H3,(H,26,28)(H,27,29)/t20-,21-/m0/s1
InChIKey RBXKJZLPVSNMPR-SFTDATJTSA-N
Molecular Weight 486.521 g/mol
SMILES N([C@@](Cc1ccc(Oc2cc(C[C@@](C(=O)OC)(NC(=O)C)[H])ccc2OC)cc1)(C(=O)OC)[H])C(=O)C
SPLASH splash10-0671-3049300000-7c84eaef6db55a15e32b
Source of Spectrum F-55-10533-6
Synonyms (S)-2-Acetylamino-3-{3-[4-((S)-2-acetylamino-2-methoxycarbonyl-ethyl)-phenoxy]-4-methoxy-phenyl}-propionic acid methyl ester Methyl (2S)-2-(acetylamino)-3-(4-{5-[(2S)-2-(acetylamino)-3-methoxy-3-oxopropyl]-2-methoxyphenoxy}phenyl)propanoate
Wiley ID 838995