5,5'-[[1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)[2,2'-binaphthalene]-8,8'-diyl]dimethylidyne]bis[2,4,6(1H,3H,5H)-Pyrimidinetrione]
[CAS# 56509-01-4]

Identification

• Name: 5,5'-[[1,1',6,6',7,7'-Hexahydroxy-3,3'-dimethyl-5,5'-bis(1-methylethyl)[2,2'-binaphthalene]-8,8'-diyl]dimethylidyne]bis[2,4,6(1H,3H,5H)-Pyrimidinetrione]
• Synonyms: 5-[[2,3,8-Trihydroxy-4-Isopropyl-6-Methyl-7-[1,6,7-Trihydroxy-5-Isopropyl-3-Methyl-8-[(2,4,6-Trioxohexahydropyrimidin-5-Ylidene)Methyl]-2-Naphthyl]-1-Naphthyl]Methylene]Hexahydropyrimidine-2,4,6-Trione; 5-[[2,3,8-Trihydroxy-4-Isopropyl-6-Methyl-7-[1,6,7-Trihydroxy-5-Isopropyl-3-Methyl-8-[(2,4,6-Trioxo-5-Hexahydropyrimidinylidene)Methyl]-2-Naphthyl]-1-Naphthyl]Methylene]Hexahydropyrimidine-2,4,6-Trione; 5-[[2,3,8-Trihydroxy-4-Isopropyl-6-Methyl-7-[1,6,7-Trihydroxy-5-Isopropyl-3-Methyl-8-[(2,4,6-Triketohexahydropyrimidin-5-Ylidene)Methyl]-2-Naphthyl]-1-Naphthyl]Methylene]Barbituric Acid
• Molecular Formula: C₃₈H₃₄N₄O₁₂
• Molecular Weight: 738.71
• CAS Registry Number: 56509-01-4
• SMILES: C1=C(C(=C(C2=C(C(=C(C(=C12)C(C)C)O)O)C=C3C(=O)NC(=O)NC3=O)O)C5=C(C4=C(C(=C(C(=C4C=C5C)C(C)C)O)O)C=C6C(=O)NC(=O)NC6=O)O)C
• InChI: 1S/C38H34N4O12/c1-11(2)21-15-7-13(5)23(29(45)25(15)17(27(43)31(21)47)9-19-33(49)39-37(53)40-34(19)50)24-14(6)8-16-22(12(3)4)32(48)28(44)18(26(16)30(24)46)10-20-35(51)41-38(54)42-36(20)52/h7-12,43-48H,1-6H3,(H2,39,40,49,50,53)(H2,41,42,51,52,54)
• InChIKey: IIRJCUDCUZICFH-UHFFFAOYSA-N

Properties

• Density: 1.542g/cm³ (Cal.)