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CHEBI:206692 - Vaccinol S
| Formula | C17H24O4 |
| Net Charge | 0 |
| Average Mass | 292.375 |
| Monoisotopic Mass | 292.16746 |
| SMILES | CC(C)=CCc1ccc(O)c2c1[C@@H](C[C@@H](O)[C@H](C)O)OC2 |
| InChI | InChI=1S/C17H24O4/c1-10(2)4-5-12-6-7-14(19)13-9-21-16(17(12)13)8-15(20)11(3)18/h4,6-7,11,15-16,18-20H,5,8-9H2,1-3H3/t11-,15+,16+/m0/s1 |
| InChIKey | JUJNVXXKTUEQPG-IUIKQTSFSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Pestalotiopsis (ncbitaxon:37840) | - | PubMed (28625729) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Vaccinol S (CHEBI:206692) is a 2-benzofurans (CHEBI:38831) |
| IUPAC Name |
|---|
| (2R,3S)-1-[(1R)-4-hydroxy-7-(3-methylbut-2-enyl)-1,3-dihydro-2-benzouran-1-yl]butane-2,3-diol |
| Manual Xrefs | Databases |
|---|---|
| 62285134 | ChemSpider |