EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C13H18N2O2 |
| Net Charge | 0 |
| Average Mass | 234.299 |
| Monoisotopic Mass | 234.13683 |
| SMILES | COc1ccc2c(c1)C(C)(CCN)C(=O)N2C |
| InChI | InChI=1S/C13H18N2O2/c1-13(6-7-14)10-8-9(17-3)4-5-11(10)15(2)12(13)16/h4-5,8H,6-7,14H2,1-3H3 |
| InChIKey | XEEBADQXIMNBQG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(2-aminoethyl)-5-methoxy-1,3-dimethyl-2-indolone (CHEBI:91824) is a indoles (CHEBI:24828) |
| Manual Xrefs | Databases |
|---|---|
| LSM-1738 | LINCS |