EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C32H22O10 |
| Net Charge | 0 |
| Average Mass | 566.518 |
| Monoisotopic Mass | 566.12130 |
| SMILES | COc1cc(O)c2c(c1)C(=O)c1cc(C)c(O)c(-c3c(OC)cc(O)c4c3C(=O)c3cc(C)c(O)cc3C4=O)c1C2=O |
| InChI | InChI=1S/C32H22O10/c1-11-5-14-15(9-18(11)33)30(38)24-20(35)10-21(42-4)25(27(24)31(14)39)26-23-16(6-12(2)28(26)36)29(37)17-7-13(41-3)8-19(34)22(17)32(23)40/h5-10,33-36H,1-4H3 |
| InChIKey | YZSAXGKYJYWVOD-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Alternariaspecies ZJ-2008003 (ncbitaxon:1081808) | - | PubMed (22276679) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Alterporriol R (CHEBI:224845) is a hydroxyanthraquinones (CHEBI:37485) |
| IUPAC Name |
|---|
| 1-(2,8-dihydroxy-6-methoxy-3-methyl-9,10-dioxoanthracen-1-yl)-4,6-dihydroxy-2-methoxy-7-methylanthracene-9,10-dione |
| Manual Xrefs | Databases |
|---|---|
| 29214728 | ChemSpider |