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CHEBI:204420 - Thielavin I
| Formula | C28H30O8 |
| Net Charge | 0 |
| Average Mass | 494.540 |
| Monoisotopic Mass | 494.19407 |
| SMILES | Cc1cc(O)c(C)c(OC(=O)c2c(C)c(C)c(OC(=O)c3c(C)cc(O)c(C)c3O)c(C)c2O)c1C |
| InChI | InChI=1S/C28H30O8/c1-11-9-20(30)17(7)25(13(11)3)35-28(34)22-14(4)15(5)26(18(8)24(22)32)36-27(33)21-12(2)10-19(29)16(6)23(21)31/h9-10,29-32H,1-8H3 |
| InChIKey | UPKGXNUGBGHQFZ-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Chaetomium (ncbitaxon:5149) | - | PubMed (12546415) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Thielavin I (CHEBI:204420) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| (3-hydroxy-2,5,6-trimethylphenyl) 4-(2,4-dihydroxy-3,6-dimethylbenzoyl)oxy-2-hydroxy-3,5,6-trimethylbenzoate |
| Manual Xrefs | Databases |
|---|---|
| 9137269 | ChemSpider |