EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H21N5O4 |
| Net Charge | 0 |
| Average Mass | 383.408 |
| Monoisotopic Mass | 383.15935 |
| SMILES | COc1cc(OC)c(OC)cc1C=NNC(=O)c1cc(-c2cccn2C)nn1 |
| InChI | InChI=1S/C19H21N5O4/c1-24-7-5-6-15(24)13-9-14(22-21-13)19(25)23-20-11-12-8-17(27-3)18(28-4)10-16(12)26-2/h5-11H,1-4H3,(H,21,22)(H,23,25) |
| InChIKey | QXDLTJZVPLCQFM-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(1-methyl-2-pyrrolyl)-N-[(2,4,5-trimethoxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide (CHEBI:116420) is a methoxybenzenes (CHEBI:51683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-27874 | LINCS |