2-Amino-3-Methylimidazo-(4,5-f)Quinoline N-Glucuronide
[CAS# 122719-39-5]

Identification

• Name: 2-Amino-3-Methylimidazo-(4,5-f)Quinoline N-Glucuronide
• Synonyms: (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[(3-Methylpyrido[3,2-E]Benzimidazol-2-Yl)Amino]Tetrahydropyran-2-Carboxylic Acid; (2S,3S,4S,5R,6R)-3,4,5-Trihydroxy-6-[(3-Methyl-2-Pyrido[3,2-E]Benzimidazolyl)Amino]-2-Tetrahydropyrancarboxylic Acid; 2-Amino-3-Methylimidazo-(4,5-F)Quinoline N-Glucuronide
• Molecular Formula: C₁₇H₁₈N₄O₆
• Molecular Weight: 374.35
• CAS Registry Number: 122719-39-5
• SMILES: [C@H]1(O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(=O)O)NC3=NC2=C4C(=CC=C2[N]3C)N=CC=C4
• InChI: 1S/C17H18N4O6/c1-21-9-5-4-8-7(3-2-6-18-8)10(9)19-17(21)20-15-13(24)11(22)12(23)14(27-15)16(25)26/h2-6,11-15,22-24H,1H3,(H,19,20)(H,25,26)/t11-,12-,13+,14-,15+/m0/s1
• InChIKey: YLRCRCCBJUCMKF-SBJFKYEJSA-N

Properties

• Density: 1.791g/cm³ (Cal.)
• Boiling point: 745.844°C at 760 mmHg (Cal.)
• Flash point: 404.872°C (Cal.)