CHEBI:225516 - Sparticolin F

ChEBI IDCHEBI:225516
ChEBI NameSparticolin F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H18O5
Net Charge0
Average Mass338.359
Monoisotopic Mass338.11542
SMILESCOC(=O)C[C@@H]1C[C@H]2[C@H](C=CC23Oc2cccc4cccc(c24)O3)O1
InChIInChI=1S/C20H18O5/c1-22-18(21)11-13-10-14-15(23-13)8-9-20(14)24-16-6-2-4-12-5-3-7-17(25-20)19(12)16/h2-9,13-15H,10-11H2,1H3/t13-,14-,15-/m0/s1
InChIKeyUZGMLZZZTKLXGC-KKUMJFAQSA-N
Species of MetaboliteComponentSourceComments
Sparticola junci (ncbitaxon:1803578) - PubMed (31599583)
ChEBI Ontology
Outgoing Relation(s)
Sparticolin F (CHEBI:225516) is a naphthalenes (CHEBI:25477)
IUPAC Name 
methyl 2-[(2S,3aS,6aS)-spiro[2,3,3a,6a-tetrahydrocyclopenta[b]uran-4,3'-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene]-2-yl]acetate
Manual XrefsDatabases
128442848ChemSpider