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CHEBI:9512 - Thalidasine
| Formula | C39H44N2O7 |
| Net Charge | 0 |
| Average Mass | 652.788 |
| Monoisotopic Mass | 652.31485 |
| SMILES | COc1ccc2cc1Oc1ccc(cc1)C[C@H]1c3cc(OC)c(OC)c(c3CCN1C)Oc1c(OC)c(OC)cc3c1[C@H](C2)N(C)CC3 |
| InChI | InChI=1S/C39H44N2O7/c1-40-17-15-27-28-22-34(44-5)37(45-6)36(27)48-39-35-25(21-33(43-4)38(39)46-7)14-16-41(2)30(35)19-24-10-13-31(42-3)32(20-24)47-26-11-8-23(9-12-26)18-29(28)40/h8-13,20-22,29-30H,14-19H2,1-7H3/t29-,30-/m0/s1 |
| InChIKey | SVQMVSCWYACSCP-KYJUHHDHSA-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) |
| Thalidasine (CHEBI:9512) is a bisbenzylisoquinoline alkaloid (CHEBI:133004) |
| Thalidasine (CHEBI:9512) is a isoquinolines (CHEBI:24922) |
| Synonym | Source |
|---|---|
| Thalidasine | KEGG COMPOUND |