EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H36N2O2 |
| Net Charge | 0 |
| Average Mass | 396.575 |
| Monoisotopic Mass | 396.27768 |
| SMILES | CC(=O)N(C[C@@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1CC1CC1)C(C)C |
| InChI | InChI=1S/C25H36N2O2/c1-17(2)26(18(3)29)15-23-25(24(16-28)27(23)14-19-8-9-19)22-12-10-21(11-13-22)20-6-4-5-7-20/h6,10-13,17,19,23-25,28H,4-5,7-9,14-16H2,1-3H3/t23-,24-,25-/m1/s1 |
| InChIKey | ZQIFSPSGLWQNLO-UBFVSLLYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[[(2S,3R,4S)-3-[4-(1-cyclopentenyl)phenyl]-1-(cyclopropylmethyl)-4-(hydroxymethyl)-2-azetidinyl]methyl]-N-propan-2-ylacetamide (CHEBI:131103) is a azetidines (CHEBI:38777) |
| N-[[(2S,3R,4S)-3-[4-(1-cyclopentenyl)phenyl]-1-(cyclopropylmethyl)-4-(hydroxymethyl)-2-azetidinyl]methyl]-N-propan-2-ylacetamide (CHEBI:131103) is a benzenes (CHEBI:22712) |
| N-[[(2S,3R,4S)-3-[4-(1-cyclopentenyl)phenyl]-1-(cyclopropylmethyl)-4-(hydroxymethyl)-2-azetidinyl]methyl]-N-propan-2-ylacetamide (CHEBI:131103) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-42651 | LINCS |