EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C29H23ClO8 |
| Net Charge | 0 |
| Average Mass | 534.948 |
| Monoisotopic Mass | 534.10815 |
| SMILES | COc1cc2c(c(-c3c(C)cc(O)c(Cl)c3OC)c1)C(=O)C1=C(C2=O)C(C)(C)c2cc(O)cc(O)c2C1=O |
| InChI | InChI=1S/C29H23ClO8/c1-11-6-18(33)24(30)28(38-5)19(11)14-9-13(37-4)10-15-20(14)26(35)22-23(25(15)34)29(2,3)16-7-12(31)8-17(32)21(16)27(22)36/h6-10,31-33H,1-5H3 |
| InChIKey | CFIYQNFHRXLRDH-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (28293036) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Naphthacemycin A6 (CHEBI:226171) is a quinone (CHEBI:36141) |
| Naphthacemycin A6 (CHEBI:226171) is a tetracenes (CHEBI:51270) |
| IUPAC Name |
|---|
| 7-(3-chloro-4-hydroxy-2-methoxy-6-methylphenyl)-2,4-dihydroxy-9-methoxy-12,12-dimethyltetracene-5,6,11-trione |
| Manual Xrefs | Databases |
|---|---|
| 78435209 | ChemSpider |