7,8-Dimethyl-5-(2,3,4,5-tetrahydroxypentyl)pyrido[4,3-b]quinoxaline-1,3-dione
[CAS# 64183-66-0]

Identification

• Name: 7,8-Dimethyl-5-(2,3,4,5-tetrahydroxypentyl)pyrido[4,3-b]quinoxaline-1,3-dione
• Synonyms: 7,8-Dimethyl-5-(2,3,4,5-Tetrahydroxypentyl)Pyrido[4,3-B]Quinoxaline-1,3-Quinone; 1-Carba-1-Deazariboflavin; 1-Deazariboflavin
• Molecular Formula: C₁₈H₂₁N₃O₆
• Molecular Weight: 375.38
• CAS Registry Number: 64183-66-0
• SMILES: C1=C(C(=CC3=C1N(C2=CC(NC(C2=N3)=O)=O)CC(C(O)C(CO)O)O)C)C
• InChI: 1S/C18H21N3O6/c1-8-3-10-11(4-9(8)2)21(6-13(23)17(26)14(24)7-22)12-5-15(25)20-18(27)16(12)19-10/h3-5,13-14,17,22-24,26H,6-7H2,1-2H3,(H,20,25,27)
• InChIKey: VVSMAKSRHMDDGV-UHFFFAOYSA-N

Properties

• Density: 1.571g/cm³ (Cal.)