EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
CHEBI:215218 - Carquinostatin B
| Formula | C21H23NO4 |
| Net Charge | 0 |
| Average Mass | 353.418 |
| Monoisotopic Mass | 353.16271 |
| SMILES | CC(C)=CCc1ccc2nc3c(c2c1)C(=O)C(=O)C(C)=C3[C@H](O)[C@@H](C)O |
| InChI | InChI=1S/C21H23NO4/c1-10(2)5-6-13-7-8-15-14(9-13)17-18(22-15)16(20(25)12(4)23)11(3)19(24)21(17)26/h5,7-9,12,20,22-23,25H,6H2,1-4H3/t12-,20-/m1/s1 |
| InChIKey | YUNXXJUUIKKYDM-MPBGBICISA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (9362126) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Carquinostatin B (CHEBI:215218) is a carbazoles (CHEBI:48513) |
| IUPAC Name |
|---|
| 1-[(1S,2R)-1,2-dihydroxypropyl]-2-methyl-6-(3-methylbut-2-enyl)-9H-carbazole-3,4-dione |
| Manual Xrefs | Databases |
|---|---|
| 8173767 | ChemSpider |