EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C30H27Cl3O8 |
| Net Charge | 0 |
| Average Mass | 621.897 |
| Monoisotopic Mass | 620.07715 |
| SMILES | COc1cc(C)c(-c2cc(OC)c(Cl)c3c2C(=O)[C@@]2(O)C(=O)c4c(O)c(Cl)c(O)c(Cl)c4C(C)(C)[C@H]2C3)c(OC)c1 |
| InChI | InChI=1S/C30H27Cl3O8/c1-11-7-12(39-4)8-15(40-5)18(11)13-9-16(41-6)22(31)14-10-17-29(2,3)21-20(25(34)24(33)26(35)23(21)32)28(37)30(17,38)27(36)19(13)14/h7-9,17,34-35,38H,10H2,1-6H3/t17-,30-/m1/s1 |
| InChIKey | XKPCUXOZLGRCDH-BJLXPSRBSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomyces formicae (ncbitaxon:1616117) | - | PubMed (28507698) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Formicamycin G (CHEBI:219470) is a tetralins (CHEBI:36786) |
| IUPAC Name |
|---|
| (5aR,11aR)-1,3,10-trichloro-7-(2,4-dimethoxy-6-methylphenyl)-2,4,5a-trihydroxy-9-methoxy-12,12-dimethyl-11,11a-dihydrotetracene-5,6-dione |
| Manual Xrefs | Databases |
|---|---|
| 58825815 | ChemSpider |