EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C23H28N4O3S |
| Net Charge | 0 |
| Average Mass | 440.569 |
| Monoisotopic Mass | 440.18821 |
| SMILES | CC=Cc1ccc2n(c1=O)C[C@H]1[C@H](CO)[C@@H](C(=O)NCC3CC3)N(Cc3nccs3)[C@@H]21 |
| InChI | InChI=1S/C23H28N4O3S/c1-2-3-15-6-7-18-20-16(11-26(18)23(15)30)17(13-28)21(22(29)25-10-14-4-5-14)27(20)12-19-24-8-9-31-19/h2-3,6-9,14,16-17,20-21,28H,4-5,10-13H2,1H3,(H,25,29)/t16-,17-,20+,21-/m0/s1 |
| InChIKey | LDJBNXGTZHCRNA-PZBISTMVSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-14634 (CHEBI:103290) is a amino acid amide (CHEBI:22475) |
| Manual Xrefs | Databases |
|---|---|
| LSM-14634 | LINCS |