Mad-cylc amp
[(2S,5R)-5-[(6-aminopurin-9-yl)methyl]-4-hydroxy-2,5-dihydrofuran-2-yl] methyl hydrogen phosphate;N,N-diethylethanamine
Also Known As: Mad-cylc amp|MAD-CYCL AMP|Methyl 5'-(6-aminopurin-9-yl)-5'-deoxy-beta-D-ribofuranoside 2',3'-cyclic monophosphate|[(2S,5R)-5-[(6-aminopurin-9-yl)methyl]-4-hydroxy-2,5-dihydrofuran-2-yl] methyl hydrogen phosphate;N,N-diethylethanamine|beta-D-Ribofuranoside, methyl 5-(6-amino-9H-purin-9-yl)-5-deoxy-, cyclic 2,3-(hydrogen phosphate), compd. with N,N-diethylethanamine (1:1)|(2S,5R)-5-[(6-Amino-9H-purin-9-yl)methyl]-4-hydroxy-2,5-dihydrofuran-2-yl methyl hydrogen phosphate--N,N-diethylethanamine (1/1)|[(2S,5R)-5-[(6-aminopurin-9-yl)methyl]-4-hydroxy-2,5-dihydrofuran-2-yl] methyl hydrogen phosphate; N,N-diethylethanamine|5-[(6-Amino-9H-purin-9-yl)methyl]-4-hydroxy-2,5-dihydrofuran-2-yl methyl hydrogen phosphate--N,N-diethylethanamine (1/1)
| Molecular Formula | C17H29N6O6P |
|---|---|
| Molecular Weight | 444.18863 g/mol |
| LogP | 1.6868 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 444.18863 |
| Monoisotopic Mass | 444.18863 |
| Heavy Atoms | 30 |
| Complexity | 547.0 |
Chemical Identifiers
| CAS Number | 76281-91-9 |
|---|---|
| SMILES | CCN(CC)CC.COP(=O)(O)O[C@H]1C=C([C@H](O1)CN2C=NC3=C(N=CN=C32)N)O |
| InChIKey | VXXYNNGJYPCHIX-WLYNEOFISA-N |
Product Overview
Mad-cylc amp (CAS 76281-91-9), with molecular formula C17H29N6O6P and molecular weight 444.18863 g/mol. IUPAC: [(2S,5R)-5-[(6-aminopurin-9-yl)methyl]-4-hydroxy-2,5-dihydrofuran-2-yl] methyl hydrogen phosphate;N,N-diethylethanamine.