6-Oxoprimapterin
[CAS# 115991-76-9]

Identification

• Name: 6-Oxoprimapterin
• Synonyms: 2-Amino-7-[(1S,2R)-1,2-Dihydroxypropyl]-1,5-Dihydropteridine-4,6-Quinone; 6-Oxo-7-Isobiopterin; 6-Oxoprimapterin
• Molecular Formula: C₉H₁₁N₅O₄
• Molecular Weight: 253.22
• CAS Registry Number: 115991-76-9
• SMILES: [C@H](O)(C1=NC2=C(NC1=O)C(=O)N=C(N2)N)[C@H](O)C
• InChI: 1S/C9H11N5O4/c1-2(15)5(16)3-7(17)12-4-6(11-3)13-9(10)14-8(4)18/h2,5,15-16H,1H3,(H,12,17)(H3,10,11,13,14,18)/t2-,5-/m1/s1
• InChIKey: IVLRTAQPNLWWKT-DUZGATOHSA-N

Properties

• Density: 2.035g/cm³ (Cal.)