EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C37H43N5O6S |
| Net Charge | 0 |
| Average Mass | 685.847 |
| Monoisotopic Mass | 685.29341 |
| SMILES | C[C@@H]1CN([C@H](C)CO)C(=O)Cc2cc(NS(=O)(=O)c3ccccc3)ccc2O[C@@H]1CN(C)Cc1ccc(C(=O)Nc2ccccc2N)cc1 |
| InChI | InChI=1S/C37H43N5O6S/c1-25-21-42(26(2)24-43)36(44)20-29-19-30(40-49(46,47)31-9-5-4-6-10-31)17-18-34(29)48-35(25)23-41(3)22-27-13-15-28(16-14-27)37(45)39-33-12-8-7-11-32(33)38/h4-19,25-26,35,40,43H,20-24,38H2,1-3H3,(H,39,45)/t25-,26-,35-/m1/s1 |
| InChIKey | PIYCFRUDBRJOMI-AZAGJHQNSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-(2-aminophenyl)-4-[[[(2S,3R)-9-(benzenesulfonamido)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl-methylamino]methyl]benzamide (CHEBI:127189) is a benzamides (CHEBI:22702) |
| Manual Xrefs | Databases |
|---|---|
| LSM-38749 | LINCS |