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CHEBI:223624 - Pestaloficiol S

ChEBI IDCHEBI:223624
ChEBI NamePestaloficiol S
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O2
Net Charge0
Average Mass228.291
Monoisotopic Mass228.11503
SMILESC=C(C)C#Cc1ccc(O)c2c1CC(C)(C)O2
InChIInChI=1S/C15H16O2/c1-10(2)5-6-11-7-8-13(16)14-12(11)9-15(3,4)17-14/h7-8,16H,1,9H2,2-4H3
InChIKeyOXUABLGHDLQARM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis fici (ncbitaxon:393283) - PubMed (23353656)
ChEBI Ontology
Outgoing Relation(s)
Pestaloficiol S (CHEBI:223624) is a 1-benzofurans (CHEBI:38830)
IUPAC Name 
2,2-dimethyl-4-(3-methylbut-3-en-1-ynyl)-3H-1-benzouran-7-ol
Manual XrefsDatabases
78434918ChemSpider