EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C11H14N2O.C4H7N3O |
| Net Charge | 0 |
| Average Mass | 303.366 |
| Monoisotopic Mass | 303.16952 |
| SMILES | CN1CC(=O)N=C1N.COc1ccc2c(CCN)cnc2c1 |
| InChI | InChI=1S/C11H14N2O.C4H7N3O/c1-14-9-2-3-10-8(4-5-12)7-13-11(10)6-9;1-7-2-3(8)6-4(7)5/h2-3,6-7,13H,4-5,12H2,1H3;2H2,1H3,(H2,5,6,8) |
| InChIKey | DFRUTGRPXJKUIB-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-amino-3-methyl-4H-imidazol-5-one 2-(6-methoxy-1H-indol-3-yl)ethanamine (CHEBI:125697) is a tryptamines (CHEBI:27162) |
| Manual Xrefs | Databases |
|---|---|
| LSM-37266 | LINCS |