EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C21H29N3O2 |
| Net Charge | 0 |
| Average Mass | 355.482 |
| Monoisotopic Mass | 355.22598 |
| SMILES | COc1ccc2c3c(n(C)c2c1)[C@@H](CO)N(C)CC31CN(CC2CC2)C1 |
| InChI | InChI=1S/C21H29N3O2/c1-22-11-21(12-24(13-21)9-14-4-5-14)19-16-7-6-15(26-3)8-17(16)23(2)20(19)18(22)10-25/h6-8,14,18,25H,4-5,9-13H2,1-3H3/t18-/m1/s1 |
| InChIKey | PFNDYBSFPBFGAZ-GOSISDBHSA-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)-1'-(cyclopropylmethyl)-7-methoxy-2,9-dimethyl-1-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]methanol (CHEBI:129332) is a harmala alkaloid (CHEBI:61379) |
| Manual Xrefs | Databases |
|---|---|
| LSM-40883 | LINCS |