EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C33H38N4O7 |
| Net Charge | 0 |
| Average Mass | 602.688 |
| Monoisotopic Mass | 602.27405 |
| SMILES | C[C@@H]1CN([C@H](C)CO)C(=O)Cc2cc(NC(=O)Cc3ccccc3)ccc2O[C@@H]1CN(C)C(=O)Nc1ccc2c(c1)OCO2 |
| InChI | InChI=1S/C33H38N4O7/c1-21-17-37(22(2)19-38)32(40)15-24-14-25(34-31(39)13-23-7-5-4-6-8-23)9-11-27(24)44-30(21)18-36(3)33(41)35-26-10-12-28-29(16-26)43-20-42-28/h4-12,14,16,21-22,30,38H,13,15,17-20H2,1-3H3,(H,34,39)(H,35,41)/t21-,22-,30-/m1/s1 |
| InChIKey | GYOWDDOKYWIKKQ-NPKFRGRUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3R)-2-[[[(1,3-benzodioxol-5-ylamino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-2-phenylacetamide (CHEBI:124487) is a acetamides (CHEBI:22160) |
| Manual Xrefs | Databases |
|---|---|
| LSM-35929 | LINCS |