EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H33N3O3 |
| Net Charge | 0 |
| Average Mass | 423.557 |
| Monoisotopic Mass | 423.25219 |
| SMILES | CC(C)CC#Cc1ccc([C@H]2[C@H](CO)N3C(=O)CN(C(=O)NC4CCCC4)C[C@@H]23)cc1 |
| InChI | InChI=1S/C25H33N3O3/c1-17(2)6-5-7-18-10-12-19(13-11-18)24-21-14-27(15-23(30)28(21)22(24)16-29)25(31)26-20-8-3-4-9-20/h10-13,17,20-22,24,29H,3-4,6,8-9,14-16H2,1-2H3,(H,26,31)/t21-,22-,24+/m0/s1 |
| InChIKey | VYSPFUUZGAOWHP-WPFOTENUSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| (6R,7R,8R)-N-cyclopentyl-8-(hydroxymethyl)-7-[4-(4-methylpent-1-ynyl)phenyl]-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide (CHEBI:126395) is a azetidines (CHEBI:38777) |
| (6R,7R,8R)-N-cyclopentyl-8-(hydroxymethyl)-7-[4-(4-methylpent-1-ynyl)phenyl]-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide (CHEBI:126395) is a benzenes (CHEBI:22712) |
| (6R,7R,8R)-N-cyclopentyl-8-(hydroxymethyl)-7-[4-(4-methylpent-1-ynyl)phenyl]-2-oxo-1,4-diazabicyclo[4.2.0]octane-4-carboxamide (CHEBI:126395) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-37960 | LINCS |