EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C28H22Cl2O7 |
| Net Charge | 0 |
| Average Mass | 541.383 |
| Monoisotopic Mass | 540.07426 |
| SMILES | COc1cc(O)c(Cl)c(C)c1-c1cc(O)c(Cl)c2cc3c(c(O)c12)C(=O)c1c(O)cc(O)cc1C3(C)C |
| InChI | InChI=1S/C28H22Cl2O7/c1-10-20(19(37-4)9-18(34)24(10)29)12-8-17(33)25(30)13-7-15-23(26(35)21(12)13)27(36)22-14(28(15,2)3)5-11(31)6-16(22)32/h5-9,31-35H,1-4H3 |
| InChIKey | OQDPQNIEZGGSQN-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces (ncbitaxon:1883) | - | PubMed (32298122) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Naphthacemycin B7 (CHEBI:226335) is a tetracenes (CHEBI:51270) |
| IUPAC Name |
|---|
| 10-chloro-7-(3-chloro-4-hydroxy-6-methoxy-2-methylphenyl)-2,4,6,9-tetrahydroxy-12,12-dimethyltetracen-5-one |
| Manual Xrefs | Databases |
|---|---|
| 128718855 | ChemSpider |