Adp-ribose
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-3,4,5-trihydroxyoxolan-2-yl]methyl hydrogen phosphate
Also Known As: ADP-ribose|adpribose|1ihy|1szd|ADP-D-ribose|ADP-beta-D-ribose|adenosine diphosphate ribose|Adenosine-5-Diphosphoribose|Adenosine 5'-diphosphoribose|5'-Diphosphoribose, Adenosine|[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-3,4,5-trihydroxyoxolan-2-yl]methyl hydrogen phosphate|((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl (((2R,3S,4R,5R)-3,4,5-trihydroxytetrahydrofuran-2-yl)methyl) dihydrogen diphosphate|adenosine 5'-[3-(beta-D-ribofuranos-5-O-yl) dihydrogen diphosphate]|(((2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl)methoxy-oxidanyl-phosphoryl) ((2R,3S,4R,5R)-3,4,5-tris(oxidanyl)oxolan-2-yl)methyl hydrogen phosphate|[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5R)-3,4,5-trihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate|[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl]methyl [(2R,3S,4R,5R)-3,4,5-trihydroxytetrahydrofuran-2-yl]methyl dihydrogen diphosphate (non-preferred name)|[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2R,3S,4R,5R)-3,4,5-tris(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate|[[(2R,3S,4R,5R)-5-adenin-9-yl-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] [(2R,3S,4R,5R)-3,4,5-trihydroxytetrahydrofuran-2-yl]methyl hydrogen phosphate|ADR|APR
| Molecular Formula | C15H23N5O14P2 |
|---|---|
| Molecular Weight | 559.07166 g/mol |
| LogP | -6.1 |
| Topological Polar Surface Area | 292.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 9 |
| Exact Mass | 559.07166 |
| Monoisotopic Mass | 559.07166 |
| Heavy Atoms | 36 |
| Complexity | 876.0 |
Chemical Identifiers
| CAS Number | 47775-00-8 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OC[C@@H]4[C@H]([C@H]([C@@H](O4)O)O)O)O)O)N |
| InChIKey | SRNWOUGRCWSEMX-KEOHHSTQSA-N |
Product Overview
Adp-ribose (CAS 47775-00-8), with molecular formula C15H23N5O14P2 and molecular weight 559.07166 g/mol. IUPAC: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-3,4,5-trihydroxyoxolan-2-yl]methyl hydrogen phosphate.