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CHEBI:31504 - dioncophylline A
| Formula | C24H27NO3 |
| Net Charge | 0 |
| Average Mass | 377.484 |
| Monoisotopic Mass | 377.19909 |
| SMILES | COc1cccc2c(-c3ccc4c(c3O)[C@@H](C)N[C@H](C)C4)c(C)cc(OC)c12 |
| InChI | InChI=1S/C24H27NO3/c1-13-11-20(28-5)23-17(7-6-8-19(23)27-4)21(13)18-10-9-16-12-14(2)25-15(3)22(16)24(18)26/h6-11,14-15,25-26H,12H2,1-5H3/t14-,15-/m1/s1 |
| InChIKey | MXIZZLBQRBAZEX-HUUCEWRRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Triphyophyllum peltatum (ncbitaxon:63090) | |||
| root (BTO:0001188) | PubMed (9371362) | ||
| stem (BTO:0001300) | PubMed (9371362) | Previous component: stem bark; |
| Roles Classification |
|---|
| Biological Roles: | antimalarial A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human. antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| Applications: | antimalarial A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human. molluscicide A substance used to destroy pests of the phylum Mollusca. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| dioncophylline A (CHEBI:31504) has role antifungal agent (CHEBI:35718) |
| dioncophylline A (CHEBI:31504) has role antimalarial (CHEBI:38068) |
| dioncophylline A (CHEBI:31504) has role metabolite (CHEBI:25212) |
| dioncophylline A (CHEBI:31504) has role molluscicide (CHEBI:33904) |
| dioncophylline A (CHEBI:31504) is a biaryl (CHEBI:64459) |
| dioncophylline A (CHEBI:31504) is a isoquinoline alkaloid (CHEBI:24921) |
| dioncophylline A (CHEBI:31504) is a isoquinolines (CHEBI:24922) |
| dioncophylline A (CHEBI:31504) is a methoxynaphthalene (CHEBI:48851) |
| dioncophylline A (CHEBI:31504) is a methylnaphthalenes (CHEBI:25324) |
| IUPAC Name |
|---|
| (1R,3R)-7-(4,5-dimethoxy-2-methylnaphthalen-1-yl)-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol |
| Synonym | Source |
|---|---|
| Dioncophylline A | KEGG COMPOUND |
| Registry Numbers | Sources |
|---|---|
| Reaxys:5830236 | Reaxys |
| CAS:60142-17-8 | KEGG COMPOUND |
| CAS:60142-17-8 | ChemIDplus |
| Citations |
|---|