[(2R,3S,4S)-5-(8-Chloro-7-Methyl-2,4-Dioxobenzo[g]Pteridin-10-Yl)-2,3,4-Trihydroxypentyl] Dihydrogen Phosphate
[CAS# 73358-82-4]

Identification

• Name: [(2R,3S,4S)-5-(8-Chloro-7-Methyl-2,4-Dioxobenzo[g]Pteridin-10-Yl)-2,3,4-Trihydroxypentyl] Dihydrogen Phosphate
• Synonyms: [(2R,3S,4S)-5-(8-Chloro-7-Methyl-2,4-Dioxo-Benzo[G]Pteridin-10-Yl)-2,3,4-Trihydroxy-Pentyl] Dihydrogen Phosphate; [(2R,3S,4S)-5-(8-Chloro-7-Methyl-2,4-Dioxo-10-Benzo[G]Pteridinyl)-2,3,4-Trihydroxypentyl] Dihydrogen Phosphate; [(2R,3S,4S)-5-(8-Chloro-2,4-Diketo-7-Methyl-Benzo[G]Pteridin-10-Yl)-2,3,4-Trihydroxy-Pentyl] Dihydrogen Phosphate
• Molecular Formula: C₁₆H₁₈ClN₄O₉P
• Molecular Weight: 476.77
• CAS Registry Number: 73358-82-4
• SMILES: [C@@H](CN1C3=C(N=C2C(NC(N=C12)=O)=O)C=C(C(=C3)Cl)C)(O)[C@H](O)[C@H](O)CO[P](=O)(O)O
• InChI: 1S/C16H18ClN4O9P/c1-6-2-8-9(3-7(6)17)21(14-12(18-8)15(25)20-16(26)19-14)4-10(22)13(24)11(23)5-30-31(27,28)29/h2-3,10-11,13,22-24H,4-5H2,1H3,(H,20,25,26)(H2,27,28,29)/t10-,11+,13-/m0/s1
• InChIKey: DKYVSFDSPHQPQL-LOWVWBTDSA-N

Properties

• Density: 1.962g/cm³ (Cal.)