EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:130885 - N-[[(2S,3R,4R)-1-(cyclopropylmethyl)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-3-fluoro-N-methylbenzamide
| Formula | C23H27FN2O2 |
| Net Charge | 0 |
| Average Mass | 382.479 |
| Monoisotopic Mass | 382.20566 |
| SMILES | CN(C[C@@H]1[C@@H](c2ccccc2)[C@H](CO)N1CC1CC1)C(=O)c1cccc(F)c1 |
| InChI | InChI=1S/C23H27FN2O2/c1-25(23(28)18-8-5-9-19(24)12-18)14-20-22(17-6-3-2-4-7-17)21(15-27)26(20)13-16-10-11-16/h2-9,12,16,20-22,27H,10-11,13-15H2,1H3/t20-,21+,22-/m1/s1 |
| InChIKey | QGIFPCGEAOQIGK-BHIFYINESA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| N-[[(2S,3R,4R)-1-(cyclopropylmethyl)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-3-fluoro-N-methylbenzamide (CHEBI:130885) is a azetidines (CHEBI:38777) |
| N-[[(2S,3R,4R)-1-(cyclopropylmethyl)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-3-fluoro-N-methylbenzamide (CHEBI:130885) is a benzenes (CHEBI:22712) |
| N-[[(2S,3R,4R)-1-(cyclopropylmethyl)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]-3-fluoro-N-methylbenzamide (CHEBI:130885) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-42434 | LINCS |