EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C13H16O5 |
| Net Charge | 0 |
| Average Mass | 252.266 |
| Monoisotopic Mass | 252.09977 |
| SMILES | Cc1cc(C(=O)O)cc2c1O[C@H](C(C)(O)CO)C2 |
| InChI | InChI=1S/C13H16O5/c1-7-3-9(12(15)16)4-8-5-10(18-11(7)8)13(2,17)6-14/h3-4,10,14,17H,5-6H2,1-2H3,(H,15,16)/t10-,13?/m0/s1 |
| InChIKey | STEGIKRDKIOQIU-NKUHCKNESA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Neosartorya (ncbitaxon:36629) | - | PubMed (27438842) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Quadricinctafuran B (CHEBI:205822) is a 1-benzofurans (CHEBI:38830) |
| IUPAC Name |
|---|
| (2S)-2-(1,2-dihydroxypropan-2-yl)-7-methyl-2,3-dihydro-1-benzouran-5-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 58197074 | ChemSpider |