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CHEBI:216999 - Graphostrin E
| Formula | C14H16O6 |
| Net Charge | 0 |
| Average Mass | 280.276 |
| Monoisotopic Mass | 280.09469 |
| SMILES | CC(=O)OC[C@@](C)(O)[C@@H]1Cc2cc(C(=O)O)ccc2O1 |
| InChI | InChI=1S/C14H16O6/c1-8(15)19-7-14(2,18)12-6-10-5-9(13(16)17)3-4-11(10)20-12/h3-5,12,18H,6-7H2,1-2H3,(H,16,17)/t12-,14+/m0/s1 |
| InChIKey | AGZADXYKMDGMON-GXTWGEPZSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Graphostroma (ncbitaxon:190933) | - | PubMed (29355320) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Graphostrin E (CHEBI:216999) is a 1-benzofurans (CHEBI:38830) |
| IUPAC Name |
|---|
| (2S)-2-[(2R)-1-acetyloxy-2-hydroxypropan-2-yl]-2,3-dihydro-1-benzouran-5-carboxylic acid |
| Manual Xrefs | Databases |
|---|---|
| 65323345 | ChemSpider |