(2R,3S,4R)-2-(Hydroxymethyl)-5-[6-[[(2R)-4-Methylpent-3-En-2-Yl]Amino]Purin-9-Yl]Oxolane-3,4-Diol
[CAS# 158300-15-3]

Identification

• Name: (2R,3S,4R)-2-(Hydroxymethyl)-5-[6-[[(2R)-4-Methylpent-3-En-2-Yl]Amino]Purin-9-Yl]Oxolane-3,4-Diol
• Synonyms: (3R,4S,5R)-2-[6-[[(1R)-1,3-Dimethylbut-2-Enyl]Amino]Purin-9-Yl]-5-(Hydroxymethyl)Tetrahydrofuran-3,4-Diol; (3R,4S,5R)-2-[6-[[(1R)-1,3-Dimethylbut-2-Enyl]Amino]-9-Purinyl]-5-(Hydroxymethyl)Tetrahydrofuran-3,4-Diol; (3R,4S,5R)-2-[6-[[(1R)-1,3-Dimethylbut-2-Enyl]Amino]Purin-9-Yl]-5-Methylol-Tetrahydrofuran-3,4-Diol
• Molecular Formula: C₁₆H₂₃N₅O₄
• Molecular Weight: 349.39
• CAS Registry Number: 158300-15-3
• SMILES: [N]3(C1O[C@@H]([C@@H](O)[C@H]1O)CO)C2=NC=NC(=C2N=C3)N[C@@H](C=C(C)C)C
• InChI: 1S/C16H23N5O4/c1-8(2)4-9(3)20-14-11-15(18-6-17-14)21(7-19-11)16-13(24)12(23)10(5-22)25-16/h4,6-7,9-10,12-13,16,22-24H,5H2,1-3H3,(H,17,18,20)/t9-,10-,12-,13-,16?/m1/s1
• InChIKey: BNELRKBQHVNRME-RXORQQCGSA-N

Properties

• Density: 1.519g/cm³ (Cal.)
• Boiling point: 641.799°C at 760 mmHg (Cal.)
• Flash point: 341.948°C (Cal.)