Adenosine 5'-(tetrahydrogen triphosphate), compd. with 2-aminoethanethiol (1:2)
[CAS# 51414-99-4]

Identification

• Name: Adenosine 5'-(tetrahydrogen triphosphate), compd. with 2-aminoethanethiol (1:2)
• Synonyms: 2-Aminoethanethiol; [[(2R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Peroxy-(Hydroxy-Oxo-Phosphaniumyl)Peroxy-Oxo-Phosphonium; 2-Aminoethanethiol; [[(2R)-5-(6-Aminopurin-9-Yl)-3,4-Dihydroxy-2-Tetrahydrofuranyl]Methoxy-Hydroxyphosphoryl]Dioxy-(Hydroxy-Oxophosphaniumyl)Dioxy-Oxophosphonium; [[(2R)-5-Adenin-9-Yl-3,4-Dihydroxy-Tetrahydrofuran-2-Yl]Methoxy-Hydroxy-Phosphoryl]Peroxy-(Hydroxy-Keto-Phosphaniumyl)Peroxy-Keto-Phosphonium; 2-Aminoethanethiol
• Molecular Formula: C₁₂H₂₁N₆O₁₃P₃S
• Molecular Weight: 582.31
• CAS Registry Number: 51414-99-4
• SMILES: [P+](OO[P](OC[C@H]3OC([N]2C1=NC=NC(=C1N=C2)N)C(O)C3O)(O)=O)(OO[P+](O)=O)=O.C(N)CS
• InChI: 1S/C10H12N5O13P3.C2H7NS/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-31(21,22)28-27-30(20)26-25-29(18)19;3-1-2-4/h2-4,6-7,10,16-17H,1H2,(H2-2,11,12,13,18,19,21,22);4H,1-3H2/p+2/t4-,6?,7?,10?;/m1./s1
• InChIKey: LXIGOSZXNSADOY-MEZUHZRNSA-P