EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C18H16O8 |
| Net Charge | 0 |
| Average Mass | 360.318 |
| Monoisotopic Mass | 360.08452 |
| SMILES | Cc1cc(O)c(C)c2c1C(=O)Oc1c(CO)c(O)c(C(=O)O)c(C)c1O2 |
| InChI | InChI=1S/C18H16O8/c1-6-4-10(20)7(2)14-11(6)18(24)26-16-9(5-19)13(21)12(17(22)23)8(3)15(16)25-14/h4,19-21H,5H2,1-3H3,(H,22,23) |
| InChIKey | INMABPVEUVMMPG-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Relicina (ncbitaxon:299002) | - | DOI (10.1071/ch9951479) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Conhypoprotocetraric acid (CHEBI:221420) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| 3,9-dihydroxy-4-(hydroxymethyl)-1,7,10-trimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 28576330 | ChemSpider |