L-Tyrosine, N-[N-[N-[(phenylmethoxy)carbonyl]-L-seryl]-L-leucyl]-, methyl ester

SpectraBase Compound ID	IgEuZ5nZ7QC
InChI	InChI=1S/C27H35N3O8/c1-17(2)13-21(24(33)29-22(26(35)37-3)14-18-9-11-20(32)12-10-18)28-25(34)23(15-31)30-27(36)38-16-19-7-5-4-6-8-19/h4-12,17,21-23,31-32H,13-16H2,1-3H3,(H,28,34)(H,29,33)(H,30,36)
InChIKey	VRWIMNXQXLLYDR-UHFFFAOYSA-N Google Search
Mol Weight	529.6 g/mol
Molecular Formula	C27H35N3O8
Exact Mass	529.242415 g/mol

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SpectraBase Spectrum ID	EAZa4eXuqM2
Name	L-Tyrosine, N-[N-[N-[(phenylmethoxy)carbonyl]-L-seryl]-L-leucyl]-, methyl ester
Alternate Name(s)	Methyl 11-(4-hydroxybenzyl)-5-(hydroxymethyl)-8-isobutyl-3,6,9-trioxo-1-phenyl-2-oxa-4,7,10-triazadodecan-12-oate 2-[[2-[[2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]-4-methyl-pentanoyl]amino]-3-(4-hydroxyphenyl)propionic acid methyl ester 2-[[2-[[3-hydroxy-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-4-methyl-1-oxopentyl]amino]-3-(4-hydroxyphenyl)propanoic acid methyl ester Methyl 2-[[2-[[2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]-4-methyl-pentanoyl]amino]-3-(4-hydroxyphenyl)propanoate Methyl 3-(4-hydroxyphenyl)-2-[[2-[[3-hydroxy-2-(phenylmethoxycarbonylamino)propanoyl]amino]-4-methylpentanoyl]amino]propanoate Methyl 3-(4-hydroxyphenyl)-2-[[4-methyl-2-[[3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoyl]amino]propanoate
CAS Registry Number	55517-95-8
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H35N3O8
InChI	InChI=1S/C27H35N3O8/c1-17(2)13-21(24(33)29-22(26(35)37-3)14-18-9-11-20(32)12-10-18)28-25(34)23(15-31)30-27(36)38-16-19-7-5-4-6-8-19/h4-12,17,21-23,31-32H,13-16H2,1-3H3,(H,28,34)(H,29,33)(H,30,36)
InChIKey	VRWIMNXQXLLYDR-UHFFFAOYSA-N
Molecular Weight	529.590 g/mol
SMILES	Oc1ccc(CC(NC(C(NC(C(CO)NC(OCc2ccccc2)=O)=O)CC(C)C)=O)C(OC)=O)cc1
SPLASH	splash10-0a6u-8922000000-47e576da5c9f1349231c
Source of Spectrum	O-3-73-3
Wiley ID	63838