EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C19H22N6O6 |
| Net Charge | 0 |
| Average Mass | 430.421 |
| Monoisotopic Mass | 430.16008 |
| SMILES | CCOc1ccccc1OCC(=O)NNC(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C |
| InChI | InChI=1S/C19H22N6O6/c1-4-30-12-7-5-6-8-13(12)31-10-15(27)22-21-14(26)9-25-11-20-17-16(25)18(28)24(3)19(29)23(17)2/h5-8,11H,4,9-10H2,1-3H3,(H,21,26)(H,22,27) |
| InChIKey | HITLLWUXFLNTQH-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-N'-[2-(2-ethoxyphenoxy)-1-oxoethyl]acetohydrazide (CHEBI:107206) is a oxopurine (CHEBI:25810) |
| Manual Xrefs | Databases |
|---|---|
| LSM-18560 | LINCS |