EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C28H31N5O3 |
| Net Charge | 0 |
| Average Mass | 485.588 |
| Monoisotopic Mass | 485.24269 |
| SMILES | CCCN1[C@@H]2c3ccc(C=Cc4ccccc4)c(=O)n3C[C@@H]2[C@@H](CO)[C@@H]1C(=O)NCc1ccncn1 |
| InChI | InChI=1S/C28H31N5O3/c1-2-14-32-25-22(23(17-34)26(32)27(35)30-15-21-12-13-29-18-31-21)16-33-24(25)11-10-20(28(33)36)9-8-19-6-4-3-5-7-19/h3-13,18,22-23,25-26,34H,2,14-17H2,1H3,(H,30,35)/t22-,23-,25+,26-/m1/s1 |
| InChIKey | HXYTZOMMTUQQOD-VHCQPULKSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-14484 (CHEBI:103139) is a amino acid amide (CHEBI:22475) |
| Manual Xrefs | Databases |
|---|---|
| LSM-14484 | LINCS |