5-(4-Benzoquinonyl)-2'-Deoxyuridine 5'-Phosphate
[CAS# 87414-22-0]

Identification

• Name: 5-(4-Benzoquinonyl)-2'-Deoxyuridine 5'-Phosphate
• Synonyms: [(2R,3S,5R)-5-[5-(3,6-Dioxo-1-Cyclohexa-1,4-Dienyl)-2,4-Dioxo-Pyrimidin-1-Yl]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate; [(2R,3S,5R)-5-[5-(3,6-Dioxo-1-Cyclohexa-1,4-Dienyl)-2,4-Dioxo-1-Pyrimidinyl]-3-Hydroxy-2-Tetrahydrofuranyl]Methyl Dihydrogen Phosphate; [(2R,3S,5R)-5-[5-(3,6-Diketo-1-Cyclohexa-1,4-Dienyl)-2,4-Diketo-Pyrimidin-1-Yl]-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
• Molecular Formula: C₁₅H₁₅N₂O₁₀P
• Molecular Weight: 414.26
• CAS Registry Number: 87414-22-0
• SMILES: [C@@H]1(C[C@@H](O[C@@H]1CO[P](=O)(O)O)N2C(NC(C(=C2)C3=CC(C=CC3=O)=O)=O)=O)O
• InChI: 1S/C15H15N2O10P/c18-7-1-2-10(19)8(3-7)9-5-17(15(22)16-14(9)21)13-4-11(20)12(27-13)6-26-28(23,24)25/h1-3,5,11-13,20H,4,6H2,(H,16,21,22)(H2,23,24,25)/t11-,12+,13+/m0/s1
• InChIKey: DNVOIKAHGQQSAD-YNEHKIRRSA-N

Properties

• Density: 1.782g/cm³ (Cal.)