(2R,3R,4S,5S)-2-(6-Aminopurin-9-Yl)-5-(Methylsulfinylmethyl)Oxolane-3,4-Diol
[CAS# 3387-65-3]

Identification

• Name: (2R,3R,4S,5S)-2-(6-Aminopurin-9-Yl)-5-(Methylsulfinylmethyl)Oxolane-3,4-Diol
• Synonyms: (2R,3R,4S,5S)-2-(6-Aminopurin-9-Yl)-5-(Methylsulfinylmethyl)Tetrahydrofuran-3,4-Diol; (2R,3R,4S,5S)-2-(6-Amino-9-Purinyl)-5-(Methylsulfinylmethyl)Tetrahydrofuran-3,4-Diol; 5'-Deoxy-5'-S-Adenosylmethyl Sulfoxide
• Molecular Formula: C₁₁H₁₅N₅O₄S
• Molecular Weight: 313.33
• CAS Registry Number: 3387-65-3
• SMILES: [C@H]3([N]2C1=C(C(=NC=N1)N)N=C2)[C@@H]([C@H](O)[C@H](O3)C[S](=O)C)O
• InChI: 1S/C11H15N5O4S/c1-21(19)2-5-7(17)8(18)11(20-5)16-4-15-6-9(12)13-3-14-10(6)16/h3-5,7-8,11,17-18H,2H2,1H3,(H2,12,13,14)/t5-,7-,8-,11-,21?/m1/s1
• InChIKey: WXOJULRVRHWMGT-JLQSGANNSA-N

Properties

• Density: 2.019g/cm³ (Cal.)
• Boiling point: 764.658°C at 760 mmHg (Cal.)
• Flash point: 416.25°C (Cal.)