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CHEBI:168854 - Methyl 7-epi-12-hydroxyjasmonate glucoside
| Formula | C19H30O9 |
| Net Charge | 0 |
| Average Mass | 402.440 |
| Monoisotopic Mass | 402.18898 |
| SMILES | COC(=O)CC1CCC(=O)C1C/C=C/CCOC1OC(CO)C(O)C(O)C1O |
| InChI | InChI=1S/C19H30O9/c1-26-15(22)9-11-6-7-13(21)12(11)5-3-2-4-8-27-19-18(25)17(24)16(23)14(10-20)28-19/h2-3,11-12,14,16-20,23-25H,4-10H2,1H3/b3-2+ |
| InChIKey | AJWIFVNLXHFTFD-NSCUHMNNSA-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) |
| Methyl 7-epi-12-hydroxyjasmonate glucoside (CHEBI:168854) is a O-acyl carbohydrate (CHEBI:52782) |
| IUPAC Name |
|---|
| methyl 2-[3-oxo-2-[(E)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypent-2-enyl]cyclopentyl]acetate |
| Manual Xrefs | Databases |
|---|---|
| HMDB0031763 | HMDB |
| 74886380 | ChemSpider |