Isodityrosine
[CAS# 83118-65-4]

Identification

• Name: Isodityrosine
• Synonyms: 2-Amino-3-[3-[4-[(2S)-2-Amino-3-Hydroxy-3-Oxo-Propyl]Phenoxy]-4-Hydroxy-Phenyl]Propanoic Acid; 2-Amino-3-[3-[4-[(2S)-2-Amino-3-Hydroxy-3-Keto-Propyl]Phenoxy]-4-Hydroxy-Phenyl]Propionic Acid; L-Tyrosine, O-(5-(2-Amino-2-Carboxyethyl)-2-Hydroxyphenyl)-
• Molecular Formula: C₁₈H₂₀N₂O₆
• Molecular Weight: 360.37
• CAS Registry Number: 83118-65-4
• SMILES: [C@H](N)(CC2=CC=C(OC1=CC(=CC=C1O)CC(N)C(=O)O)C=C2)C(=O)O
• 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-LSLKUGRBSA-N