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CHEBI:168459 - Stearyl citrate
| Formula | C24H44O7 |
| Net Charge | 0 |
| Average Mass | 444.609 |
| Monoisotopic Mass | 444.30870 |
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)CC(O)(CC(=O)O)C(=O)O |
| InChI | InChI=1S/C24H44O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-31-22(27)20-24(30,23(28)29)19-21(25)26/h30H,2-20H2,1H3,(H,25,26)(H,28,29) |
| InChIKey | REVZBRXEBPWDRA-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) |
| Stearyl citrate (CHEBI:168459) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| 2-hydroxy-2-(2-octadecoxy-2-oxoethyl)butanedioic acid |
| Manual Xrefs | Databases |
|---|---|
| 9786768 | ChemSpider |
| HMDB0032521 | HMDB |
| Registry Numbers | Sources |
|---|---|
| CAS:67939-31-5 | ChemIDplus |