EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C10H14O4 |
| Net Charge | 0 |
| Average Mass | 198.218 |
| Monoisotopic Mass | 198.08921 |
| SMILES | COc1cc(CC(O)CO)ccc1O |
| InChI | InChI=1S/C10H14O4/c1-14-10-5-7(2-3-9(10)13)4-8(12)6-11/h2-3,5,8,11-13H,4,6H2,1H3 |
| InChIKey | QGFJORGLNPWXMK-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(4-hydroxy-3-methoxyphenyl)propane-1,2-diol (CHEBI:125366) is a methoxybenzenes (CHEBI:51683) |
| 3-(4-hydroxy-3-methoxyphenyl)propane-1,2-diol (CHEBI:125366) is a phenols (CHEBI:33853) |
| Manual Xrefs | Databases |
|---|---|
| LSM-36842 | LINCS |
| HMDB0033093 | HMDB |