Adenylyl-tyrosine
[CAS# 6372-08-3]

Identification

• Name: Adenylyl-tyrosine
• Synonyms: [(2S)-2-Amino-3-(4-Hydroxyphenyl)Propyl] [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methyl Hydrogen Phosphate; [(2S)-2-Amino-3-(4-Hydroxyphenyl)Propyl] [(2R,3S,4R,5R)-5-(6-Amino-9-Purinyl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methyl Hydrogen Phosphate; [(2S)-2-Amino-3-(4-Hydroxyphenyl)Propyl] [(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Oxolan-2-Yl]Methyl Hydrogen Phosphate
• Molecular Formula: C₁₉H₂₅N₆O₈P
• Molecular Weight: 496.42
• CAS Registry Number: 6372-08-3
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H]1O)CO[P](OC[C@@H](N)CC2=CC=C(O)C=C2)(=O)O)[N]3C4=C(N=C3)C(=NC=N4)N
• InChI: 1S/C19H25N6O8P/c20-11(5-10-1-3-12(26)4-2-10)6-31-34(29,30)32-7-13-15(27)16(28)19(33-13)25-9-24-14-17(21)22-8-23-18(14)25/h1-4,8-9,11,13,15-16,19,26-28H,5-7,20H2,(H,29,30)(H2,21,22,23)/t11-,13+,15+,16+,19+/m0/s1
• InChIKey: JJLCVHBFTXDJMM-KFAHYOAQSA-N

Properties

• Density: 1.847g/cm³ (Cal.)
• Boiling point: 864.772°C at 760 mmHg (Cal.)
• Flash point: 476.797°C (Cal.)