EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H35N5O5S |
| Net Charge | 0 |
| Average Mass | 517.652 |
| Monoisotopic Mass | 517.23589 |
| SMILES | C[C@@H]1CN([C@H](C)CO)C(=O)c2cc(C3=CCCCC3)cnc2O[C@H]1CN(C)S(=O)(=O)c1cn(C)cn1 |
| InChI | InChI=1S/C25H35N5O5S/c1-17-12-30(18(2)15-31)25(32)21-10-20(19-8-6-5-7-9-19)11-26-24(21)35-22(17)13-29(4)36(33,34)23-14-28(3)16-27-23/h8,10-11,14,16-18,22,31H,5-7,9,12-13,15H2,1-4H3/t17-,18-,22+/m1/s1 |
| InChIKey | LKPBUWUQVMPFSV-HMFYCAOWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[[(2R,3R)-8-(1-cyclohexenyl)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N,1-dimethyl-4-imidazolesulfonamide (CHEBI:119714) is a aromatic ether (CHEBI:35618) |
| Manual Xrefs | Databases |
|---|---|
| LSM-31158 | LINCS |