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CHEBI:42223 - emodin
| Formula | C15H10O5 |
| Net Charge | 0 |
| Average Mass | 270.240 |
| Monoisotopic Mass | 270.05282 |
| SMILES | Cc1cc(O)c2c(c1)C(=O)c1cc(O)cc(O)c1C2=O |
| InChI | InChI=1S/C15H10O5/c1-6-2-8-12(10(17)3-6)15(20)13-9(14(8)19)4-7(16)5-11(13)18/h2-5,16-18H,1H3 |
| InChIKey | RHMXXJGYXNZAPX-UHFFFAOYSA-N |
| Wikipedia |
|---|
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Microdiplodia (ncbitaxon:371130) | - | PubMed (21244021) | EtOAc extract of an endophytic fungi isolated from Lycium intricatum Strain: 9907 |
| Roles Classification |
|---|
| Biological Roles: | plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. tyrosine kinase inhibitor Any protein kinase inhibitor that interferes with the action of tyrosine kinase. |
| Applications: | laxative An agent that produces a soft formed stool, and relaxes and loosens the bowels, typically used over a protracted period, to relieve constipation. Compare with cathartic, which is a substance that accelerates defecation. A substances can be both a laxative and a cathartic. antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| emodin (CHEBI:42223) has functional parent emodin anthrone (CHEBI:150013) |
| emodin (CHEBI:42223) has role antineoplastic agent (CHEBI:35610) |
| emodin (CHEBI:42223) has role laxative (CHEBI:50503) |
| emodin (CHEBI:42223) has role plant metabolite (CHEBI:76924) |
| emodin (CHEBI:42223) has role tyrosine kinase inhibitor (CHEBI:38637) |
| emodin (CHEBI:42223) is a trihydroxyanthraquinone (CHEBI:37488) |
| emodin (CHEBI:42223) is conjugate acid of emodin(1−) (CHEBI:77659) |
| Incoming Relation(s) |
| isoskyrin (CHEBI:144065) has functional parent emodin (CHEBI:42223) |
| questin (CHEBI:16200) has functional parent emodin (CHEBI:42223) |
| skyrin (CHEBI:144311) has functional parent emodin (CHEBI:42223) |
| emodin(1−) (CHEBI:77659) is conjugate base of emodin (CHEBI:42223) |
| IUPAC Name |
|---|
| 1,3,8-trihydroxy-6-methylanthra-9,10-quinone |
| Synonyms | Source |
|---|---|
| Emodin | KEGG COMPOUND |
| 1,3,8-trihydroxy-6-methyl-9,10-anthracenedione | ChemIDplus |
| 1,3,8-trihydroxy-6-methyl-9,10-anthraquinone | ChemIDplus |
| 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | PDBeChem |
| Schuttgelb | ChemIDplus |
| Citations |
|---|