EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C6H13O7P |
| Net Charge | 0 |
| Average Mass | 228.137 |
| Monoisotopic Mass | 228.03989 |
| SMILES | CC(O)(CCOP(=O)(O)O)CC(=O)O |
| InChI | InChI=1S/C6H13O7P/c1-6(9,4-5(7)8)2-3-13-14(10,11)12/h9H,2-4H2,1H3,(H,7,8)(H2,10,11,12) |
| InChIKey | OKZYCXHTTZZYSK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-hydroxy-3-methyl-5-phosphonooxypentanoic acid (CHEBI:125405) is a monoalkyl phosphate (CHEBI:25381) |
| Manual Xrefs | Databases |
|---|---|
| LSM-36890 | LINCS |