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CHEBI:210469 - Paralactonic acid D
| Formula | C12H16O6 |
| Net Charge | 0 |
| Average Mass | 256.254 |
| Monoisotopic Mass | 256.09469 |
| SMILES | C[C@H]1C=C(CCC(=O)O)C(=O)O[C@H]1CCC(=O)O |
| InChI | InChI=1S/C12H16O6/c1-7-6-8(2-4-10(13)14)12(17)18-9(7)3-5-11(15)16/h6-7,9H,2-5H2,1H3,(H,13,14)(H,15,16)/t7-,9-/m0/s1 |
| InChIKey | STMLBESERUTGPE-CBAPKCEASA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Paraconiothyrium (ncbitaxon:300251) | - | PubMed (30496810) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Paralactonic acid D (CHEBI:210469) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| 3-[(2S,3S)-5-(2-carboxyethyl)-3-methyl-6-oxo-2,3-dihydropyran-2-yl]propanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 71116007 | ChemSpider |