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CHEBI:225261 - Pestalotiphain F

ChEBI IDCHEBI:225261
ChEBI NamePestalotiphain F
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O6
Net Charge0
Average Mass340.416
Monoisotopic Mass340.18859
SMILESCO[C@@H]1/C=C(\C)C[C@H](OC(C)=O)[C@]2(O)[C@H](CC2(C)C)[C@@H](CO)C1=O
InChIInChI=1S/C18H28O6/c1-10-6-14(23-5)16(21)12(9-19)13-8-17(3,4)18(13,22)15(7-10)24-11(2)20/h6,12-15,19,22H,7-9H2,1-5H3/b10-6+/t12-,13-,14-,15+,18-/m1/s1
InChIKeyZWGWYYHFKBAQTP-FKDIQLLPSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis hainanensis (ncbitaxon:679339) - PubMed (33064488)
ChEBI Ontology
Outgoing Relation(s)
Pestalotiphain F (CHEBI:225261) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(1S,2S,4E,6R,8S,9R)-1-hydroxy-8-(hydroxymethyl)-6-methoxy-4,11,11-trimethyl-7-oxo-2-bicyclo[7.2.0]undec-4-enyl] acetate