N-(4-(((2-Amino-3,4,5,6,7,8-Hexahydro-4-Oxo-5-((2'-Deoxyuridin-5-Yl)Methyl)Pyrido[3,2-d]Pyrimidin-6-Yl)Methyl)Amino)Benzoyl)Glutamic Acid 5'-Monophosphate
[CAS# 92008-00-9]

Identification

• Name: N-(4-(((2-Amino-3,4,5,6,7,8-Hexahydro-4-Oxo-5-((2'-Deoxyuridin-5-Yl)Methyl)Pyrido[3,2-d]Pyrimidin-6-Yl)Methyl)Amino)Benzoyl)Glutamic Acid 5'-Monophosphate
• Synonyms: 2-[[4-[[2-Amino-5-[[1-[4-Hydroxy-5-(Phosphonooxymethyl)Tetrahydrofuran-2-Yl]-2,4-Dioxo-Pyrimidin-5-Yl]Methyl]-4-Oxo-1,6,7,8-Tetrahydropyrido[6,5-E]Pyrimidin-6-Yl]Methylamino]Benzoyl]Amino]Pentanedioic Acid; 2-[[[4-[[2-Amino-5-[[1-[4-Hydroxy-5-(Phosphonooxy
• Molecular Formula: C₃₀H₃₇N₈O₁₄P
• Molecular Weight: 764.64
• CAS Registry Number: 92008-00-9
• SMILES: C5=C(NCC2N(C1=C(NC(=NC1=O)N)CC2)CC4=CN(C3OC(C(O)C3)CO[P](=O)(O)O)C(=O)NC4=O)C=CC(=C5)C(=O)NC(C(=O)O)CCC(=O)O
• InChI: 1S/C30H37N8O14P/c31-29-34-18-6-5-17(10-32-16-3-1-14(2-4-16)25(42)33-19(28(45)46)7-8-23(40)41)37(24(18)27(44)35-29)11-15-12-38(30(47)36-26(15)43)22-9-20(39)21(52-22)13-51-53(48,49)50/h1-4,12,17,19-22,32,39H,5-11,13H2,(H,33,42)(H,40,41)(H,45,46)(H,36,43,47)
• InChIKey: SCFXNVIWVSBPLO-UHFFFAOYSA-N

Properties

• Density: 1.847g/cm³ (Cal.)