EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C14H22O7 |
| Net Charge | 0 |
| Average Mass | 302.323 |
| Monoisotopic Mass | 302.13655 |
| SMILES | CCCCOC(=O)CC1(O)C(=O)OC1C(=O)OCCCC |
| InChI | InChI=1S/C14H22O7/c1-3-5-7-19-10(15)9-14(18)11(21-13(14)17)12(16)20-8-6-4-2/h11,18H,3-9H2,1-2H3 |
| InChIKey | TYDSJOYVIREIOH-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) |
| Garcinia lactone dibutyl ester (CHEBI:167937) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| butyl 3-(2-butoxy-2-oxoethyl)-3-hydroxy-4-oxooxetane-2-carboxylate |
| Manual Xrefs | Databases |
|---|---|
| 35014946 | ChemSpider |
| HMDB0040462 | HMDB |