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L-Tyrosine, O-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl]-, (S)-
SpectraBase Compound ID 8XVIMZurN55
InChI InChI=1S/C18H20N2O6/c19-13(17(22)23)7-10-1-4-12(5-2-10)26-16-9-11(3-6-15(16)21)8-14(20)18(24)25/h1-6,9,13-14,21H,7-8,19-20H2,(H,22,23)(H,24,25)/t13-,14-/m0/s1
InChIKey FWZXNPNHUWFOCM-KBPBESRZSA-N
Mol Weight 360.37 g/mol
Molecular Formula C18H20N2O6
Exact Mass 360.132136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HDFmod90nm4
Name L-Tyrosine, O-[5-(2-amino-2-carboxyethyl)-2-hydroxyphenyl]-, (S)-
Alternate Name(s) (2S)-2-amino-3-(4-{5-[(2S)-2-amino-2-carboxyethyl]-2-hydroxyphenoxy}phenyl)propanoic acid L,L-isodityrosine (2S)-2-amino-3-[4-[5-[(2S)-2-amino-2-carboxyethyl]-2-hydroxyphenoxy]phenyl]propanoic acid (2S)-2-amino-3-[4-[5-[(2S)-2-amino-2-carboxy-ethyl]-2-hydroxy-phenoxy]phenyl]propanoic acid (2S)-2-azanyl-3-[4-[5-[(2S)-2-azanyl-3-oxidanyl-3-oxidanylidene-propyl]-2-oxidanyl-phenoxy]phenyl]propanoic acid
CAS Registry Number 113351-28-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O6
InChI InChI=1S/C18H20N2O6/c19-13(17(22)23)7-10-1-4-12(5-2-10)26-16-9-11(3-6-15(16)21)8-14(20)18(24)25/h1-6,9,13-14,21H,7-8,19-20H2,(H,22,23)(H,24,25)/t13-,14-/m0/s1
InChIKey FWZXNPNHUWFOCM-KBPBESRZSA-N
Molecular Weight 360.366 g/mol
SMILES OC([C@](Cc1ccc(Oc2c(ccc(c2)C[C@@](C(=O)O)(N)[H])O)cc1)(N)[H])=O
SPLASH splash10-00di-0092000000-2c80437a870c2dc27e77
Source of Spectrum J-55-6011-15
Wiley ID 1348211