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CHEBI:226236 - Talarophilone A

ChEBI IDCHEBI:226236
ChEBI NameTalarophilone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H20O7
Net Charge0
Average Mass384.384
Monoisotopic Mass384.12090
SMILESC/C=C/C1CC2=CC(=O)[C@](C)(OC(=O)c3c(C)cc(O)cc3O)C(=O)C2=CO1
InChIInChI=1S/C21H20O7/c1-4-5-14-7-12-8-17(24)21(3,19(25)15(12)10-27-14)28-20(26)18-11(2)6-13(22)9-16(18)23/h4-6,8-10,14,22-23H,7H2,1-3H3/b5-4+/t14?,21-/m0/s1
InChIKeyGQHZLNYGAZJLKZ-XXTDUPGISA-N
Species of MetaboliteComponentSourceComments
Talaromycesspecies CMB-W045 (ncbitaxon:1811500) - DOI (10.1016/j.tetlet.2019.151157)
ChEBI Ontology
Outgoing Relation(s)
Talarophilone A (CHEBI:226236) is a 4-hydroxybenzoate ester (CHEBI:79323)
IUPAC Name 
[(7S)-7-methyl-6,8-dioxo-3-[(E)-prop-1-enyl]-3,4-dihydroisochromen-7-yl] 2,4-dihydroxy-6-methylbenzoate