5,6-Dihydroxy-1-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-5-Methyl-1,3-Diazinane-2,4-Dione
[CAS# 32645-65-1]

Identification

• Name: 5,6-Dihydroxy-1-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Oxolan-2-Yl]-5-Methyl-1,3-Diazinane-2,4-Dione
• Synonyms: 5,6-Dihydroxy-1-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)Tetrahydrofuran-2-Yl]-5-Methyl-Hexahydropyrimidine-2,4-Dione; 5,6-Dihydroxy-1-[(2R,4S,5R)-4-Hydroxy-5-(Hydroxymethyl)-2-Tetrahydrofuranyl]-5-Methylhexahydropyrimidine-2,4-Dione; 5,6-Dihydroxy-1-[(2R,4S,5R)-4-Hydroxy-5-Methylol-Tetrahydrofuran-2-Yl]-5-Methyl-5,6-Dihydrouracil
• Molecular Formula: C₁₀H₁₆N₂O₇
• Molecular Weight: 276.25
• CAS Registry Number: 32645-65-1
• SMILES: [C@H]1(O[C@@H]([C@@H](O)C1)CO)N2C(O)C(O)(C(=O)NC2=O)C
• InChI: 1S/C10H16N2O7/c1-10(18)7(15)11-9(17)12(8(10)16)6-2-4(14)5(3-13)19-6/h4-6,8,13-14,16,18H,2-3H2,1H3,(H,11,15,17)/t4-,5+,6+,8?,10?/m0/s1
• InChIKey: RKEITGVZZHXKON-SKAWGCAZSA-N

Properties

• Density: 1.645g/cm³ (Cal.)

References

• (1): Joshy Joseph and Gary B. Schuster. One-electron oxidation of DNA: reaction at thymine, Chem. Commun., 2010, 46, 7872.