EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C16H22O6 |
| Net Charge | 0 |
| Average Mass | 310.346 |
| Monoisotopic Mass | 310.14164 |
| SMILES | O=C(O)CCCCC(=O)CC[C@H]1C(=O)C=C[C@@H]1CCC(=O)O |
| InChI | InChI=1S/C16H22O6/c17-12(3-1-2-4-15(19)20)7-8-13-11(5-9-14(13)18)6-10-16(21)22/h5,9,11,13H,1-4,6-8,10H2,(H,19,20)(H,21,22)/t11-,13-/m1/s1 |
| InChIKey | KPFBKANRLYZJQP-DGCLKSJQSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Ganoderma lucidum (ncbitaxon:5315) | |||
| primordium (BTO:0001886) | MetaboLights (MTBLS3577) | ||
| fruit body (BTO:0000487) | MetaboLights (MTBLS3577) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| tetranor-PGJM (CHEBI:183603) is a oxo carboxylic acid (CHEBI:25754) |
| IUPAC Name |
|---|
| 8-[(1R,2S)-2-(2-carboxyethyl)-5-oxocyclopent-3-en-1-yl]-6-oxooctanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 29341942 | ChemSpider |