EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H28N2O3 |
| Net Charge | 0 |
| Average Mass | 404.510 |
| Monoisotopic Mass | 404.20999 |
| SMILES | CC=Cc1ccc([C@@H]2[C@H](CO)N(C(=O)CC)C23CN(C(=O)c2ccccc2)C3)cc1 |
| InChI | InChI=1S/C25H28N2O3/c1-3-8-18-11-13-19(14-12-18)23-21(15-28)27(22(29)4-2)25(23)16-26(17-25)24(30)20-9-6-5-7-10-20/h3,5-14,21,23,28H,4,15-17H2,1-2H3/t21-,23+/m0/s1 |
| InChIKey | PXRWFIGLNIQOHC-JTHBVZDNSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| LSM-41427 (CHEBI:129876) is a azetidines (CHEBI:38777) |
| LSM-41427 (CHEBI:129876) is a benzenes (CHEBI:22712) |
| LSM-41427 (CHEBI:129876) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-41427 | LINCS |