Disodium,[[(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Oxido-Phosphoryl] [(3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl] Phosphate
[CAS# 102129-65-7]

Identification

• Name: Disodium,[[(2R,3S,4R,5R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Oxido-Phosphoryl] [(3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl] Phosphate
• Synonyms: Adenosine-5′-diphosphoglucose disodium salt; Adenosine-5'-diphosphoglucose disodium salt; ADPG
• Molecular Formula: C₁₆H₂₃N₅Na₂O₁₅P₂
• Molecular Weight: 633.30
• CAS Registry Number: 102129-65-7
• SMILES: [Na+].[Na+].O=P([O-])(OC1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)OP([O-])(=O)OC[C@H]4O[C@@H](n2c3ncnc(N)c3nc2)[C@H](O)[C@@H]4O
• InChI: 1S/C16H25N5O15P2.2Na/c17-13-7-14(19-3-18-13)21(4-20-7)15-11(26)9(24)6(33-15)2-32-37(28,29)36-38(30,31)35-16-12(27)10(25)8(23)5(1-22)34-16;;/h3-6,8-12,15-16,22-27H,1-2H2,(H,28,29)(H,30,31)(H2,17,18,19);;/q;2*+1/p-2/t5-,6-,8-,9-,10+,11-,12-,15-,16?;;/m1../s1
• InChIKey: GZBIVALVIPYODS-UQGWVDHFSA-L

Properties

• Refractive index: (Cal.)