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L-Tyrosine, 3-[4-(hydroxymethyl)phenoxy]-N-[(phenylmethoxy)carbonyl]-O-(phenylmethyl)-, methyl ester
SpectraBase Compound ID 3MojxC0iAgH
InChI InChI=1S/C32H31NO7/c1-37-31(35)28(33-32(36)39-22-25-10-6-3-7-11-25)18-26-14-17-29(38-21-24-8-4-2-5-9-24)30(19-26)40-27-15-12-23(20-34)13-16-27/h2-17,19,28,34H,18,20-22H2,1H3,(H,33,36)/t28-/m0/s1
InChIKey ROEFVDZWRJMCQZ-NDEPHWFRSA-N
Mol Weight 541.6 g/mol
Molecular Formula C32H31NO7
Exact Mass 541.210052 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13fUhAEvWXZ
Name L-Tyrosine, 3-[4-(hydroxymethyl)phenoxy]-N-[(phenylmethoxy)carbonyl]-O-(phenylmethyl)-, methyl ester
CAS Registry Number 120385-11-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H31NO7
InChI InChI=1S/C32H31NO7/c1-37-31(35)28(33-32(36)39-22-25-10-6-3-7-11-25)18-26-14-17-29(38-21-24-8-4-2-5-9-24)30(19-26)40-27-15-12-23(20-34)13-16-27/h2-17,19,28,34H,18,20-22H2,1H3,(H,33,36)/t28-/m0/s1
InChIKey ROEFVDZWRJMCQZ-NDEPHWFRSA-N
Molecular Weight 541.600 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@@](Cc1cc(Oc2ccc(CO)cc2)c(cc1)OCc1ccccc1)(C(=O)OC)[H]
SPLASH splash10-0006-9110000000-02cffe372527c851107b
Source of Spectrum J-55-6010-27
Synonyms Methyl (2S)-2-{[(benzyloxy)carbonyl]amino}-3-{4-(benzyloxy)-3-[4-(hydroxymethyl)phenoxy]phenyl}propanoate N-[(phenylmethoxy)carbonyl]-O-(phenylmethyl)-3-[4-(hydroxymethyl)phenoxy]-L-tyrosine methyl ester
Wiley ID 1404749