EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H35N3O3 |
| Net Charge | 0 |
| Average Mass | 425.573 |
| Monoisotopic Mass | 425.26784 |
| SMILES | COCC#Cc1ccc([C@H]2[C@H](CO)N3CCCCN(C(=O)NC4CCCC4)C[C@@H]23)cc1 |
| InChI | InChI=1S/C25H35N3O3/c1-31-16-6-7-19-10-12-20(13-11-19)24-22-17-27(25(30)26-21-8-2-3-9-21)14-4-5-15-28(22)23(24)18-29/h10-13,21-24,29H,2-5,8-9,14-18H2,1H3,(H,26,30)/t22-,23-,24+/m0/s1 |
| InChIKey | LNDCJTLPGUEJLJ-KMDXXIMOSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (8R,9R,10R)-N-cyclopentyl-10-(hydroxymethyl)-9-[4-(3-methoxyprop-1-ynyl)phenyl]-1,6-diazabicyclo[6.2.0]decane-6-carboxamide (CHEBI:128160) is a azetidines (CHEBI:38777) |
| (8R,9R,10R)-N-cyclopentyl-10-(hydroxymethyl)-9-[4-(3-methoxyprop-1-ynyl)phenyl]-1,6-diazabicyclo[6.2.0]decane-6-carboxamide (CHEBI:128160) is a benzenes (CHEBI:22712) |
| (8R,9R,10R)-N-cyclopentyl-10-(hydroxymethyl)-9-[4-(3-methoxyprop-1-ynyl)phenyl]-1,6-diazabicyclo[6.2.0]decane-6-carboxamide (CHEBI:128160) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-39715 | LINCS |