EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C13H20O5 |
| Net Charge | 0 |
| Average Mass | 256.298 |
| Monoisotopic Mass | 256.13107 |
| SMILES | C=C(C(=O)O)/C(=C\CCCC[C@@H](O)CC)C(=O)O |
| InChI | InChI=1S/C13H20O5/c1-3-10(14)7-5-4-6-8-11(13(17)18)9(2)12(15)16/h8,10,14H,2-7H2,1H3,(H,15,16)(H,17,18)/b11-8+/t10-/m0/s1 |
| InChIKey | NSVBQXZBZSCZMM-NGPGYTDTSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Tricladium castaneicola (ncbitaxon:693256) | - | PubMed (25875311) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Tricladic acid B (CHEBI:204417) is a carbonyl compound (CHEBI:36586) |
| IUPAC Name |
|---|
| (2E)-2-[(6S)-6-hydroxyoctylidene]-3-methylidenebutanedioic acid |
| Manual Xrefs | Databases |
|---|---|
| 59006769 | ChemSpider |