EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:28204 - 4-hydroxy-4-methyl-2-oxoadipic acid
| Formula | C7H10O6 |
| Net Charge | 0 |
| Average Mass | 190.151 |
| Monoisotopic Mass | 190.04774 |
| SMILES | CC(O)(CC(=O)O)CC(=O)C(=O)O |
| InChI | InChI=1S/C7H10O6/c1-7(13,3-5(9)10)2-4(8)6(11)12/h13H,2-3H2,1H3,(H,9,10)(H,11,12) |
| InChIKey | VSMPEEWSBJTSLD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-hydroxy-4-methyl-2-oxoadipic acid (CHEBI:28204) has functional parent adipic acid (CHEBI:30832) |
| 4-hydroxy-4-methyl-2-oxoadipic acid (CHEBI:28204) is a oxo dicarboxylic acid (CHEBI:36145) |
| Synonyms | Source |
|---|---|
| 4-Hydroxy-4-methyl-2-oxoadipate | KEGG COMPOUND |
| 4-hydroxy-4-methyl-2-oxoadipate | ChEBI |