CHEBI:206796 - Talaromyone B

ChEBI IDCHEBI:206796
ChEBI NameTalaromyone B
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SubmitterMetaboLights
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FormulaC23H26O7
Net Charge0
Average Mass414.454
Monoisotopic Mass414.16785
SMILESCOc1c([C@H](CC(C)C)OC(C)=O)ccc2c1C(=O)Oc1cc(C)cc(CO)c1O2
InChIInChI=1S/C23H26O7/c1-12(2)8-18(28-14(4)25)16-6-7-17-20(22(16)27-5)23(26)30-19-10-13(3)9-15(11-24)21(19)29-17/h6-7,9-10,12,18,24H,8,11H2,1-5H3/t18-/m0/s1
InChIKeyIQUKZMHSFDVXJQ-SFHVURJKSA-N
Species of MetaboliteComponentSourceComments
Talaromyces (ncbitaxon:5094) - DOI (10.1016/j.phytol.2017.04.023)
ChEBI Ontology
Outgoing Relation(s)
Talaromyone B (CHEBI:206796) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
[(1S)-1-[1-(hydroxymethyl)-7-methoxy-3-methyl-6-oxobenzo[b][1,4]benzodioxepin-8-yl]-3-methylbutyl] acetate
Manual XrefsDatabases
63002588ChemSpider