EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C14H15N3O4S |
| Net Charge | 0 |
| Average Mass | 321.358 |
| Monoisotopic Mass | 321.07833 |
| SMILES | COc1ccc(C(C)=NNC2=NC(=O)CC(C(=O)O)S2)cc1 |
| InChI | InChI=1S/C14H15N3O4S/c1-8(9-3-5-10(21-2)6-4-9)16-17-14-15-12(18)7-11(22-14)13(19)20/h3-6,11H,7H2,1-2H3,(H,19,20)(H,15,17,18) |
| InChIKey | GGGAIFBVFDAWTG-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-[2-[1-(4-methoxyphenyl)ethylidene]hydrazinyl]-4-oxo-5,6-dihydro-1,3-thiazine-6-carboxylic acid (CHEBI:114275) is a methoxybenzenes (CHEBI:51683) |
| Manual Xrefs | Databases |
|---|---|
| LSM-25735 | LINCS |