EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C28H30N2O3 |
| Net Charge | 0 |
| Average Mass | 442.559 |
| Monoisotopic Mass | 442.22564 |
| SMILES | COc1cccc(CN2CC3(C2)[C@H](c2ccccc2)[C@H](CO)N3C(=O)Cc2ccccc2)c1 |
| InChI | InChI=1S/C28H30N2O3/c1-33-24-14-8-11-22(15-24)17-29-19-28(20-29)27(23-12-6-3-7-13-23)25(18-31)30(28)26(32)16-21-9-4-2-5-10-21/h2-15,25,27,31H,16-20H2,1H3/t25-,27+/m0/s1 |
| InChIKey | RRMFIXDZWOGFGB-AHKZPQOWSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 1-[(2R,3R)-2-(hydroxymethyl)-6-[(3-methoxyphenyl)methyl]-3-phenyl-1,6-diazaspiro[3.3]heptan-1-yl]-2-phenylethanone (CHEBI:128696) is a azetidines (CHEBI:38777) |
| 1-[(2R,3R)-2-(hydroxymethyl)-6-[(3-methoxyphenyl)methyl]-3-phenyl-1,6-diazaspiro[3.3]heptan-1-yl]-2-phenylethanone (CHEBI:128696) is a benzenes (CHEBI:22712) |
| 1-[(2R,3R)-2-(hydroxymethyl)-6-[(3-methoxyphenyl)methyl]-3-phenyl-1,6-diazaspiro[3.3]heptan-1-yl]-2-phenylethanone (CHEBI:128696) is a ring assembly (CHEBI:36820) |
| Manual Xrefs | Databases |
|---|---|
| LSM-40250 | LINCS |