EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C9H10O4 |
| Net Charge | 0 |
| Average Mass | 182.175 |
| Monoisotopic Mass | 182.05791 |
| SMILES | [H]C(=O)C(O)c1ccc(O)c(OC)c1 |
| InChI | InChI=1S/C9H10O4/c1-13-9-4-6(8(12)5-10)2-3-7(9)11/h2-5,8,11-12H,1H3 |
| InChIKey | VISAJVAPYPFKCL-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | - | PubMed (19425150) | Source: BioModels - MODEL1507180067 |
| Roles Classification |
|---|
| Biological Role: | mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-methoxy-4-hydroxyphenylglycolaldehyde (CHEBI:27932) has functional parent 3,4-dihydroxymandelaldehyde (CHEBI:27852) |
| 3-methoxy-4-hydroxyphenylglycolaldehyde (CHEBI:27932) has role mouse metabolite (CHEBI:75771) |
| 3-methoxy-4-hydroxyphenylglycolaldehyde (CHEBI:27932) is a glycolaldehydes (CHEBI:24387) |
| 3-methoxy-4-hydroxyphenylglycolaldehyde (CHEBI:27932) is a monomethoxybenzene (CHEBI:25235) |
| 3-methoxy-4-hydroxyphenylglycolaldehyde (CHEBI:27932) is a phenols (CHEBI:33853) |
| IUPAC Name |
|---|
| hydroxy(4-hydroxy-3-methoxyphenyl)acetaldehyde |
| Synonyms | Source |
|---|---|
| 3-methoxy-4-hydroxyphenylglycolaldehyde | KEGG COMPOUND |
| 2-hydroxy-2-(4-hydroxy-3-methoxyphenyl)acetaldehyde | ChEBI |
| 4-hydroxy-3-methoxymandelaldehyde | ChEBI |
| 4-hydroxy-3-methoxyphenylglycolaldehyde | ChEBI |
| α,4-dihydroxy-3-methoxybenzeneacetaldehyde | ChEBI |
| Manual Xrefs | Databases |
|---|---|
| C05583 | KEGG COMPOUND |
| HMDB0004061 | HMDB |
| FDB023294 | FooDB |
| 389601 | ChemSpider |
| Registry Numbers | Sources |
|---|---|
| CAS:17592-23-3 | ChEBI |
| Citations |
|---|