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CHEBI:200042 - 6-hydroxymetatacarboline D
| Formula | C24H26N4O8 |
| Net Charge | 0 |
| Average Mass | 498.492 |
| Monoisotopic Mass | 498.17506 |
| SMILES | C[C@@H](O)[C@H](NC(=O)c1cc2c(nc3ccc(O)cc32)c(CCC(=O)N2CCC[C@H]2C(=O)O)n1)C(=O)O |
| InChI | InChI=1S/C24H26N4O8/c1-11(29)20(24(35)36)27-22(32)17-10-14-13-9-12(30)4-5-15(13)26-21(14)16(25-17)6-7-19(31)28-8-2-3-18(28)23(33)34/h4-5,9-11,18,20,26,29-30H,2-3,6-8H2,1H3,(H,27,32)(H,33,34)(H,35,36)/t11-,18+,20+/m1/s1 |
| InChIKey | HYBYPROKTWYUIQ-PEECDGGASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mycena metata (ncbitaxon:1033252) | - | PubMed (23330951) |
| 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) |
| 6-hydroxymetatacarboline D (CHEBI:200042) is a harmala alkaloid (CHEBI:61379) |
| IUPAC Name |
|---|
| (2S)-1-[3-[3-[[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl]-6-hydroxy-9H-pyrido[3,4-b]indol-1-yl]propanoyl]pyrrolidine-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 28637704 | ChemSpider |