3'-O-(Naphthoyl-1)adenosine diphosphate
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] naphthalene-1-carboxylate
Also Known As: 3-NP-ADP|3'-O-(Naphthoyl-1)adenosine diphosphate|3'-o-(naphthalen-1-ylcarbonyl)adenosine 5'-(trihydrogen diphosphate)|Adenosine 5'-(trihydrogen diphosphate), 3'-(1-naphthalenecarboxylate)|[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] naphthalene-1-carboxylate|3'-O-(Naphthalene-1-carbonyl)adenosine 5'-(trihydrogen diphosphate)|9-{5-O-[Hydroxy(phosphonooxy)phosphoryl]-3-O-(naphthalene-1-carbonyl)pentofuranosyl}-9H-purin-6-amine|bis{6-bromo-2-[4-(diethylamino)phenyl]-1-ethylbenzo[cd]indolium} naphthalene-1,5-disulfonate
| Molecular Formula | C21H21N5O11P2 |
|---|---|
| Molecular Weight | 581.0713 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 239.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 9 |
| Exact Mass | 581.0713 |
| Monoisotopic Mass | 581.0713 |
| Heavy Atoms | 39 |
| Complexity | 990.0 |
Chemical Identifiers
| CAS Number | 7399-13-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2C(=O)O[C@@H]3[C@H](O[C@H]([C@@H]3O)N4C=NC5=C(N=CN=C54)N)COP(=O)(O)OP(=O)(O)O |
| InChIKey | YCSLKNYVZVBVQF-WVSUBDOOSA-N |
Product Overview
3'-O-(Naphthoyl-1)adenosine diphosphate (CAS 7399-13-5), with molecular formula C21H21N5O11P2 and molecular weight 581.0713 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] naphthalene-1-carboxylate.
3'-O-(Naphthoyl-1)adenosine diphosphate is a custom synthesis product. We offer services from milligram to kilogram scale.
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