Quinoxaline-3,4-Dihydro-6,7-Dimethyl-3-Keto-4-D-Ribityl-2-Carboxamide
[CAS# 13698-42-5]

Identification

• Name: Quinoxaline-3,4-Dihydro-6,7-Dimethyl-3-Keto-4-D-Ribityl-2-Carboxamide
• Synonyms: 6,7-Dimethyl-3-Oxo-4-[(2S,3S,4R)-2,3,4,5-Tetrahydroxypentyl]-2-Quinoxalinecarboxamide; 3-Keto-6,7-Dimethyl-4-[(2S,3S,4R)-2,3,4,5-Tetrahydroxypentyl]Quinoxaline-2-Carboxamide; Quinoxaline-3,4-Dihydro-6,7-Dimethyl-3-Keto-4-D-Ribityl-2-Carboxamide""
• Molecular Formula: C₁₆H₂₁N₃O₆
• Molecular Weight: 351.36
• CAS Registry Number: 13698-42-5
• SMILES: [C@@H](CN1C(C(=NC2=C1C=C(C(=C2)C)C)C(=O)N)=O)(O)[C@H](O)[C@H](O)CO
• InChI: 1S/C16H21N3O6/c1-7-3-9-10(4-8(7)2)19(16(25)13(18-9)15(17)24)5-11(21)14(23)12(22)6-20/h3-4,11-12,14,20-23H,5-6H2,1-2H3,(H2,17,24)/t11-,12+,14-/m0/s1
• InChIKey: GHQNEPLXHNPTCF-SCRDCRAPSA-N

Properties

• Density: 1.545g/cm³ (Cal.)
• Boiling point: 686.967°C at 760 mmHg (Cal.)
• Flash point: 369.265°C (Cal.)