EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C25H31N3O3 |
| Net Charge | 0 |
| Average Mass | 421.541 |
| Monoisotopic Mass | 421.23654 |
| SMILES | COc1ccc2c3c(n(C)c2c1)[C@@H](CO)N(Cc1ccccc1OC)CC31CN(C)C1 |
| InChI | InChI=1S/C25H31N3O3/c1-26-14-25(15-26)16-28(12-17-7-5-6-8-22(17)31-4)21(13-29)24-23(25)19-10-9-18(30-3)11-20(19)27(24)2/h5-11,21,29H,12-16H2,1-4H3/t21-/m1/s1 |
| InChIKey | WYGDYSSFKWJKCK-OAQYLSRUSA-N |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| [(1S)-7-methoxy-2-[(2-methoxyphenyl)methyl]-1',9-dimethyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:126773) is a harmala alkaloid (CHEBI:61379) |
| Manual Xrefs | Databases |
|---|---|
| LSM-38336 | LINCS |