EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C32H42N4O4 |
| Net Charge | 0 |
| Average Mass | 546.712 |
| Monoisotopic Mass | 546.32061 |
| SMILES | C[C@H]1CN([C@@H](C)CO)C(=O)Cc2cc(NC(=O)Cc3cn(C)c4ccccc34)ccc2O[C@@H]1CN(C)CC1CC1 |
| InChI | InChI=1S/C32H42N4O4/c1-21-16-36(22(2)20-37)32(39)15-24-13-26(11-12-29(24)40-30(21)19-34(3)17-23-9-10-23)33-31(38)14-25-18-35(4)28-8-6-5-7-27(25)28/h5-8,11-13,18,21-23,30,37H,9-10,14-17,19-20H2,1-4H3,(H,33,38)/t21-,22-,30+/m0/s1 |
| InChIKey | XTMZZNGHRLVNPC-MWXNICTNSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[(2S,3S)-2-[[cyclopropylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-2-(1-methyl-3-indolyl)acetamide (CHEBI:128917) is a indoles (CHEBI:24828) |
| Manual Xrefs | Databases |
|---|---|
| LSM-40469 | LINCS |