7-(6'-Deoxy-beta-D-Allofuranosyl)Guanine
[CAS# 85421-88-1]

Identification

• Name: 7-(6'-Deoxy-beta-D-Allofuranosyl)Guanine
• Synonyms: 2-Amino-7-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(1-Hydroxyethyl)Tetrahydrofuran-2-Yl]-3H-Purin-6-One; 2-Amino-7-[(2R,3R,4S,5R)-3,4-Dihydroxy-5-(1-Hydroxyethyl)-2-Tetrahydrofuranyl]-3H-Purin-6-One; 7-Dafg
• Molecular Formula: C₁₁H₁₅N₅O₅
• Molecular Weight: 297.27
• CAS Registry Number: 85421-88-1
• SMILES: [C@@H]1(O)[C@H](O)[C@H](O[C@H]1[N]2C3=C(N=C2)NC(=NC3=O)N)[C@@H](C)O
• InChI: 1S/C11H15N5O5/c1-3(17)7-5(18)6(19)10(21-7)16-2-13-8-4(16)9(20)15-11(12)14-8/h2-3,5-7,10,17-19H,1H3,(H3,12,14,15,20)/t3-,5+,6-,7-,10-/m1/s1
• InChIKey: QZETUFAHUBZEHL-KPCPHYELSA-N

Properties

• Density: 2.113g/cm³ (Cal.)
• Boiling point: 744.269°C at 760 mmHg (Cal.)
• Flash point: 403.92°C (Cal.)