EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C20H25N10O9P |
| Net Charge | 0 |
| Average Mass | 580.455 |
| Monoisotopic Mass | 580.15436 |
| SMILES | Nc1nc(=O)c2ncn([C@H]3C[C@H](OP(=O)(O)OC[C@H]4O[C@@H](n5cnc6c(N)ncnc65)C[C@@H]4O)[C@@H](CO)O3)c2n1 |
| InChI | InChI=1S/C20H25N10O9P/c21-16-14-17(24-5-23-16)29(6-25-14)12-1-8(32)11(38-12)4-36-40(34,35)39-9-2-13(37-10(9)3-31)30-7-26-15-18(30)27-20(22)28-19(15)33/h5-13,31-32H,1-4H2,(H,34,35)(H2,21,23,24)(H3,22,27,28,33)/t8-,9-,10+,11+,12+,13+/m0/s1 |
| InChIKey | JRABXRXRIUUBTJ-LSUSWQKBSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| dGpdA (CHEBI:165814) is a nucleoside analogue (CHEBI:60783) |
| dGpdA (CHEBI:165814) is a purines (CHEBI:26401) |
| IUPAC Name |
|---|
| (2R,3S,5R)-5-(2-amino-6-oxo-1,6-dihydro-9H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl [(2R,3S,5R)-5-(6-amino-9H-purin-9-yl)-3-hydroxytetrahydrofuran-2-yl]methyl hydrogen phosphate |
| Manual Xrefs | Databases |
|---|---|
| 62986800 | ChemSpider |