EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C18H21NO6 |
| Net Charge | 0 |
| Average Mass | 347.367 |
| Monoisotopic Mass | 347.13689 |
| SMILES | COc1ccc(OC)c(N=CC2C(=O)OC3(CCCCC3)OC2=O)c1 |
| InChI | InChI=1S/C18H21NO6/c1-22-12-6-7-15(23-2)14(10-12)19-11-13-16(20)24-18(25-17(13)21)8-4-3-5-9-18/h6-7,10-11,13H,3-5,8-9H2,1-2H3 |
| InChIKey | FHUJLXGEEYYMNZ-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-32019 (CHEBI:120576) is a dimethoxybenzene (CHEBI:51681) |
| Manual Xrefs | Databases |
|---|---|
| LSM-32019 | LINCS |