Poly(2'-methylthioadenylic acid)
[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Also Known As: 2-methylthio-AMP|2MeSAMP|Poly(2'-methylthioadenylic acid)|2-Methylthioadenosine 5-monophosphate|2-MeS-5'-AMP|GTPL1764|2-Methylthioadenosine5-monophosphate|[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate|2-(methylsulfanyl)adenosine 5'-(dihydrogen phosphate)|2-(Methylthio)adenosine 5 -phosphoric acid|J1.572.336J|5'-Adenylic acid, 2-(methylthio)-, homopolymer|5'-Adenylic acid,2-(methylthio)-, homopolymer (9CI)|2- Methylthioadenosine- 5'- O- monophosphate, sodium salt|((2R,3S,4R,5R)-5-(6-Amino-2-(methylthio)-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl dihydrogen phosphate|{[(2R,3S,4R,5R)-5-[6-amino-2-(methylsulfanyl)-9H-purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid|[(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanyl-purin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate
| Molecular Formula | C11H16N5O7PS |
|---|---|
| Molecular Weight | 393.0508 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 5 |
| Exact Mass | 393.0508 |
| Monoisotopic Mass | 393.0508 |
| Heavy Atoms | 25 |
| Complexity | 529.0 |
Chemical Identifiers
| CAS Number | 91059-32-4 |
|---|---|
| SMILES | CSC1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N |
| InChIKey | XVTFTCNRRAQHEQ-KQYNXXCUSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Poly(2'-methylthioadenylic acid) (CAS 91059-32-4), with molecular formula C11H16N5O7PS and molecular weight 393.0508 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-amino-2-methylsulfanylpurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate.