EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C12H11NO5 |
| Net Charge | 0 |
| Average Mass | 249.222 |
| Monoisotopic Mass | 249.06372 |
| SMILES | COc1c(C(=O)NCC(=O)O)ccc2occc12 |
| InChI | InChI=1S/C12H11NO5/c1-17-11-7-4-5-18-9(7)3-2-8(11)12(16)13-6-10(14)15/h2-5H,6H2,1H3,(H,13,16)(H,14,15) |
| InChIKey | ALHJTFFFSQGYSH-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Sarcophaga peregrina (ncbitaxon:7386) | Whole Organism (NCIT:C13413) | MetaboLights (MTBLS4102) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 2-{[hydroxy(4-methoxy-1-benzofuran-5-yl)methylidene]amino}acetic acid (CHEBI:189795) is a N-acyl-amino acid (CHEBI:51569) |
| IUPAC Name |
|---|
| 2-[(4-methoxy-1-benzouran-5-carbonyl)amino]acetic acid |
| Manual Xrefs | Databases |
|---|---|
| HMDB0129408 | HMDB |
| 74852585 | ChemSpider |