EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C24H32N4O6S |
| Net Charge | 0 |
| Average Mass | 504.609 |
| Monoisotopic Mass | 504.20426 |
| SMILES | C[C@H]1CN([C@@H](C)CO)C(=O)Cc2cc(NC(=O)c3ccncc3)ccc2O[C@@H]1CN(C)S(C)(=O)=O |
| InChI | InChI=1S/C24H32N4O6S/c1-16-13-28(17(2)15-29)23(30)12-19-11-20(26-24(31)18-7-9-25-10-8-18)5-6-21(19)34-22(16)14-27(3)35(4,32)33/h5-11,16-17,22,29H,12-15H2,1-4H3,(H,26,31)/t16-,17-,22+/m0/s1 |
| InChIKey | BHBSJGZZHOSEPA-PNLZDCPESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl(methylsulfonyl)amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide (CHEBI:124347) is a pyridinecarboxamide (CHEBI:25529) |
| Manual Xrefs | Databases |
|---|---|
| LSM-35789 | LINCS |