Ferric-adenosine triphosphate complex
[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;iron
Also Known As: ATP-Fe(III) Complex|Fe(III)-ATP Complex|Iron(III)-ATP complex|Ferric-adenosine triphosphate complex|Adenosine triphosphate-iron complex|SID:85286107|adenosine 5'-(tetrahydrogen triphosphate)- iron(1:1)|Adenosine 5'-(tetrahydrogen triphosphate), iron salt|Adenosine 5'-(tetrahydrogen triphosphate)--iron (1/1)|[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate; iron
| Molecular Formula | C10H16FeN5O13P3 |
|---|---|
| Molecular Weight | 562.93066 g/mol |
| LogP | -1.6315 |
| Topological Polar Surface Area | 279.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 8 |
| Exact Mass | 562.93066 |
| Monoisotopic Mass | 562.93066 |
| Heavy Atoms | 32 |
| Complexity | 800.0 |
Chemical Identifiers
| CAS Number | 6308-07-2 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N.[Fe] |
| InChIKey | VVMRAHJVSUNRDP-MCDZGGTQSA-N |
Product Overview
Ferric-adenosine triphosphate complex (CAS 6308-07-2), with molecular formula C10H16FeN5O13P3 and molecular weight 562.93066 g/mol. IUPAC: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;iron.