beta,gamma-Methylene-7,8-Dihydroneopterin 3'-Triphosphate
[CAS# 92587-05-8]

Identification

• Name: beta,gamma-Methylene-7,8-Dihydroneopterin 3'-Triphosphate
• Synonyms: [[[(2R,3S)-3-(2-Amino-4-Oxo-7,8-Dihydro-1H-Pteridin-6-Yl)-2,3-Dihydroxy-Propoxy]-Hydroxy-Phosphoryl]Oxy-Hydroxy-Phosphoryl]Methylphosphonic Acid; [[[(2R,3S)-3-(2-Amino-4-Keto-7,8-Dihydro-1H-Pteridin-6-Yl)-2,3-Dihydroxy-Propoxy]-Hydroxy-Phosphoryl]Oxy-Hydro
• Molecular Formula: C₁₀H₁₈N₅O₁₂P₃
• Molecular Weight: 493.20
• CAS Registry Number: 92587-05-8
• SMILES: [C@H](C2=NC1=C(NC(=NC1=O)N)NC2)([C@H](O)CO[P](O[P](O)(=O)C[P](O)(=O)O)(=O)O)O
• InChI: 1S/C10H18N5O12P3/c11-10-14-8-6(9(18)15-10)13-4(1-12-8)7(17)5(16)2-26-30(24,25)27-29(22,23)3-28(19,20)21/h5,7,16-17H,1-3H2,(H,22,23)(H,24,25)(H2,19,20,21)(H4,11,12,14,15,18)/t5-,7+/m1/s1
• InChIKey: VSEUOJKUXDWIQG-VDTYLAMSSA-N

Properties

• Density: 2.476g/cm³ (Cal.)
• Boiling point: 901.299°C at 760 mmHg (Cal.)
• Flash point: 498.888°C (Cal.)