EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C13H16O8 |
| Net Charge | 0 |
| Average Mass | 300.263 |
| Monoisotopic Mass | 300.08452 |
| SMILES | COC(=O)C(O)C(O)(Cc1ccc(O)c(O)c1)C(=O)OC |
| InChI | InChI=1S/C13H16O8/c1-20-11(17)10(16)13(19,12(18)21-2)6-7-3-4-8(14)9(15)5-7/h3-5,10,14-16,19H,6H2,1-2H3 |
| InChIKey | QHQANDJGWIVAAC-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Malus domestica (ncbitaxon:3750) | exocarp (BTO:0000733) | MetaboLights (MTBLS2384) | Strain: Malus x domestica Borkh. cv. Ruixue |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Dimethyl fukiic acid (CHEBI:168420) is a catechols (CHEBI:33566) |
| IUPAC Name |
|---|
| dimethyl 2-[(3,4-dihydroxyphenyl)methyl]-2,3-dihydroxybutanedioate |
| Manual Xrefs | Databases |
|---|---|
| 35013062 | ChemSpider |
| HMDB0029497 | HMDB |