![6-amino-9-[3-hydroxy-5-[(hydroxy-sulfooxy-phosphoryl)oxymethyl]-4-phosphonooxy-oxolan-2-yl]-purine structure, CAS 482-67-7](/structures/210000/190932_1_482_67_7.png)
CAS Number482-67-7
Synonyms[5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methyl sulfo hydrogen phosphate; [5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methyl sulfo hydrogen phosphate; [5-(6-amino-9-purinyl)-4-hydroxy-3-phosphonooxy-2-tetrahydrofuranyl]methyl sulfo hydrogen phosphate; [5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-oxolan-2-yl]methyl sulfo hydrogen phosphate; 5-phosphoadenosine 3-phosphosulfate
Molecular FormulaC10H15N5O13P2S
Molecular Weight507.26 (free acid basis)
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 482-67-7 |
| Catalog No. | 2A-2189521 |
| Synonyms | [5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methyl sulfo hydrogen phosphate; [5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-tetrahydrofuran-2-yl]methyl sulfo hydrogen phosphate; [5-(6-amino-9-purinyl)-4-hydroxy-3-phosphonooxy-2-tetrahydrofuranyl]methyl sulfo hydrogen phosphate; [5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxy-oxolan-2-yl]methyl sulfo hydrogen phosphate; 5-phosphoadenosine 3-phosphosulfate |
| Molecular Formula | C10H15N5O13P2S |
| Molecular Weight | 507.26 (free acid basis) |
| PubChem ID | 329770342 |
| MDL Number | MFCD21363373 |
| SMILES | Nc1ncnc2n(cnc12)C3OC(CO[P](O)(=O)O[S](O)(=O)=O)C(O[P](O)(O)=O)C3O |
| InChI | InChI=1S/C10H15N5O13P2S/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(16)7(27-29(17,18)19)4(26-10)1-25-30(20,21)28-31(22,23)24/h2-4,6-7,10,16H,1H2,(H,20,21)(H2,11,12,13)(H2,17,18,19)(H,22,23,24) |
| InChI Key | InChIKey=GACDQMDRPRGCTN-UHFFFAOYSA-N |
| NACRES Code | NA.32 |
| UNSPSC | 12352204 |
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