Adiphene
[CAS# 100596-78-9]

Identification

• Name: Adiphene
• Synonyms: 5-Ethyl-1-[6-(5-Ethyl-2,4,6-Trioxo-5-Phenyl-Hexahydropyrimidin-1-Yl)-6-Oxo-Hexanoyl]-5-Phenyl-Hexahydropyrimidine-2,4,6-Trione; 5-Ethyl-1-[6-(5-Ethyl-2,4,6-Trioxo-5-Phenyl-1-Hexahydropyrimidinyl)-1,6-Dioxohexyl]-5-Phenylhexahydropyrimidine-2,4,6-Trione; 5-Ethyl-1-[6-(5-Ethyl-2,4,6-Triketo-5-Phenyl-Hexahydropyrimidin-1-Yl)-6-Keto-Hexanoyl]-5-Phenyl-Barbituric Acid
• Molecular Formula: C₃₀H₃₀N₄O₈
• Molecular Weight: 574.59
• CAS Registry Number: 100596-78-9
• SMILES: C1=CC=CC=C1C4(C(NC(N(C(CCCCC(=O)N2C(NC(C(C2=O)(C3=CC=CC=C3)CC)=O)=O)=O)C4=O)=O)=O)CC
• InChI: 1S/C30H30N4O8/c1-3-29(19-13-7-5-8-14-19)23(37)31-27(41)33(25(29)39)21(35)17-11-12-18-22(36)34-26(40)30(4-2,24(38)32-28(34)42)20-15-9-6-10-16-20/h5-10,13-16H,3-4,11-12,17-18H2,1-2H3,(H,31,37,41)(H,32,38,42)
• InChIKey: KGGYJLFQFUTMDA-UHFFFAOYSA-N