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CHEBI:199763 - F01-1358B

ChEBI IDCHEBI:199763
ChEBI NameF01-1358B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H28O5
Net Charge0
Average Mass360.450
Monoisotopic Mass360.19367
SMILESCOc1c(C)c2c(c(O)c1C/C=C(\C)CCC[C@H](C)C(C)=O)C(=O)OC2
InChIInChI=1S/C21H28O5/c1-12(7-6-8-13(2)15(4)22)9-10-16-19(23)18-17(11-26-21(18)24)14(3)20(16)25-5/h9,13,23H,6-8,10-11H2,1-5H3/b12-9+/t13-/m0/s1
InChIKeyHRYHMFTVUSXJPA-SRXBQZRASA-N
Species of MetaboliteComponentSourceComments
Penicillium brevicompactum (ncbitaxon:5074) - PubMed (19575040)
ChEBI Ontology
Outgoing Relation(s)
F01-1358B (CHEBI:199763) is a 2-benzofurans (CHEBI:38831)
IUPAC Name 
6-[(E)-3,7-dimethyl-8-oxonon-2-enyl]-7-hydroxy-5-methoxy-4-methyl-3H-2-benzouran-1-one
Manual XrefsDatabases
78434641ChemSpider