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CHEBI:189898 - 3-(2H-1,3-benzodioxol-5-yl)-3-oxopropanoic acid
| Formula | C10H8O5 |
| Net Charge | 0 |
| Average Mass | 208.169 |
| Monoisotopic Mass | 208.03717 |
| SMILES | O=C(O)CC(=O)c1ccc2c(c1)OCO2 |
| InChI | InChI=1S/C10H8O5/c11-7(4-10(12)13)6-1-2-8-9(3-6)15-5-14-8/h1-3H,4-5H2,(H,12,13) |
| InChIKey | YUYMTOPBCBOWKR-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| marine plankton environmental sample (ncbitaxon:632957) | endometabolome | MetaboLights (MTBLS3038) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 3-(2H-1,3-benzodioxol-5-yl)-3-oxopropanoic acid (CHEBI:189898) is a benzodioxoles (CHEBI:38298) |
| IUPAC Name |
|---|
| 3-(1,3-benzodioxol-5-yl)-3-oxopropanoic acid |
| Manual Xrefs | Databases |
|---|---|
| 13401346 | ChemSpider |
| HMDB0129376 | HMDB |