EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C21H28N2O3 |
| Net Charge | 0 |
| Average Mass | 356.466 |
| Monoisotopic Mass | 356.20999 |
| SMILES | COc1cc(CN2CCN(c3cccc(C)c3C)CC2)cc(OC)c1O |
| InChI | InChI=1S/C21H28N2O3/c1-15-6-5-7-18(16(15)2)23-10-8-22(9-11-23)14-17-12-19(25-3)21(24)20(13-17)26-4/h5-7,12-13,24H,8-11,14H2,1-4H3 |
| InChIKey | FMKSCNHGTVSCMD-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[[4-(2,3-dimethylphenyl)-1-piperazinyl]methyl]-2,6-dimethoxyphenol (CHEBI:122021) is a piperazines (CHEBI:26144) |
| Manual Xrefs | Databases |
|---|---|
| LSM-33464 | LINCS |