Basic information
- CAS
47775-00-8- Standard SMILES
Nc1ncnc2c1ncn2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]2O[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H]1O- InChIKey
SRNWOUGRCWSEMX-KEOHHSTQSA-N- Molecular formula
- C15H23N5O14P2
- Average molar mass
- 559.32 g/mol
- Monoisotopic mass
- 559.07167442
Overview
ADP-beta-D-ribose is an ADP-D-ribose with alpha configuration at the anomeric centre.
Names & identifiers
- Preferred name
- Adp-ribose
- 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
Names & synonyms
47775-00-8DTXSID301345826(((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-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 phosphateRefChem:1076197DTXCID601774490Adp-ribose((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-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(2R,3S,4R,5R)-3,4,5-trihydroxyoxolan-2-yl]methyl hydrogen phosphateAdenosine 5'-diphosphoribose1ihy1szd
Show more names
ADP-beta-D-riboseorb3237892CHEMBL1231026CHEBI:191409C00301adenosine 5'-[3-(beta-D-ribofuranos-5-O-yl) 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[(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)
Properties
Computed structural properties
- XLogP
- -6.1
- Topological polar surface area
- 292 Ų
- Hydrogen bond donors
- 8
- Hydrogen bond acceptors
- 18
- Rotatable bonds
- 9
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 876
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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