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CHEBI:205928 - Penibenzone A

ChEBI IDCHEBI:205928
ChEBI NamePenibenzone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H26O7
Net Charge0
Average Mass414.454
Monoisotopic Mass414.16785
SMILESCOc1c([C@H](CC(C)C)OC(C)=O)ccc(O)c1C(=O)c1c(O)cc(C)cc1C=O
InChIInChI=1S/C23H26O7/c1-12(2)8-19(30-14(4)25)16-6-7-17(26)21(23(16)29-5)22(28)20-15(11-24)9-13(3)10-18(20)27/h6-7,9-12,19,26-27H,8H2,1-5H3/t19-/m0/s1
InChIKeyYFAAXYFTAMLVMS-IBGZPJMESA-N
Species of MetaboliteComponentSourceComments
Talaromyces purpureogenus (ncbitaxon:1266744) - PubMed (31833397)
ChEBI Ontology
Outgoing Relation(s)
Penibenzone A (CHEBI:205928) is a benzophenones (CHEBI:22726)
IUPAC Name 
[1-[3-(2-ormyl-6-hydroxy-4-methylbenzoyl)-4-hydroxy-2-methoxyphenyl]-3-methylbutyl] acetate