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L-Tyrosine, 3-[4-(hydroxymethyl)phenoxy]-N-[(phenylmethoxy)carbonyl]-o-(phenylmethyl)-
SpectraBase Compound ID BVzMm4kmo70
InChI InChI=1S/C31H29NO7/c33-19-22-11-14-26(15-12-22)39-29-18-25(13-16-28(29)37-20-23-7-3-1-4-8-23)17-27(30(34)35)32-31(36)38-21-24-9-5-2-6-10-24/h1-16,18,27,33H,17,19-21H2,(H,32,36)(H,34,35)/t27-/m0/s1
InChIKey MCCMSZSLMVQGHN-MHZLTWQESA-N
Mol Weight 527.57 g/mol
Molecular Formula C31H29NO7
Exact Mass 527.194402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEFFdfzVYDG
Name L-Tyrosine, 3-[4-(hydroxymethyl)phenoxy]-N-[(phenylmethoxy)carbonyl]-O-(phenylmethyl)-
CAS Registry Number 127559-15-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H29NO7
InChI InChI=1S/C31H29NO7/c33-19-22-11-14-26(15-12-22)39-29-18-25(13-16-28(29)37-20-23-7-3-1-4-8-23)17-27(30(34)35)32-31(36)38-21-24-9-5-2-6-10-24/h1-16,18,27,33H,17,19-21H2,(H,32,36)(H,34,35)/t27-/m0/s1
InChIKey MCCMSZSLMVQGHN-MHZLTWQESA-N
Molecular Weight 527.573 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@](Cc1cc(Oc2ccc(CO)cc2)c(cc1)OCc1ccccc1)(C(=O)O)[H]
SPLASH splash10-0006-9000000000-a8c57c45c66ee482bdb5
Source of Spectrum J-55-6014-117
Synonyms (2S)-2-{[(benzyloxy)carbonyl]amino}-3-{4-(benzyloxy)-3-[4-(hydroxymethyl)phenoxy]phenyl}propanoic acid N-[(phenylmethoxy)carbonyl]-O-(phenylmethyl)-3-(4-(hydroxymethyl)phenoxy]-L-tyrosine
Wiley ID 1402967