EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C7H9NO4 |
| Net Charge | 0 |
| Average Mass | 171.152 |
| Monoisotopic Mass | 171.05316 |
| SMILES | NC1=CC(=O)[C@]2(CO)O[C@@H]2[C@H]1O |
| InChI | InChI=1S/C7H9NO4/c8-3-1-4(10)7(2-9)6(12-7)5(3)11/h1,5-6,9,11H,2,8H2/t5-,6+,7-/m0/s1 |
| InChIKey | JKNVJVJEQNRUFL-XVMARJQXSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Actinomyces (ncbitaxon:1654) | - | PubMed (12243453) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Cetoniacytone B (CHEBI:207657) is a cyclohexenones (CHEBI:48953) |
| IUPAC Name |
|---|
| (1R,5S,6R)-4-amino-5-hydroxy-1-(hydroxymethyl)-7-oxabicyclo[4.1.0]hept-3-en-2-one |