EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C22H23N5 |
| Net Charge | 0 |
| Average Mass | 357.461 |
| Monoisotopic Mass | 357.19535 |
| SMILES | CC(C)c1ccc(C2C(C#N)=C(N)C(C#N)(C#N)C3=CCN(C)CC32)cc1 |
| InChI | InChI=1S/C22H23N5/c1-14(2)15-4-6-16(7-5-15)20-17(10-23)21(26)22(12-24,13-25)19-8-9-27(3)11-18(19)20/h4-8,14,18,20H,9,11,26H2,1-3H3 |
| InChIKey | RZZPFYJDTQFYDP-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 6-amino-2-methyl-8-(4-propan-2-ylphenyl)-1,3,8,8a-tetrahydroisoquinoline-5,5,7-tricarbonitrile (CHEBI:94272) is a monoterpenoid (CHEBI:25409) |
| Manual Xrefs | Databases |
|---|---|
| LSM-4898 | LINCS |