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CHEBI:144140 - Confluentic acid

Default Structure
ChEBI IDCHEBI:144140
ChEBI NameConfluentic acid
Stars
Submittermwilliams
DownloadsMolfile
FormulaC28H36O8
Net Charge0
Average Mass500.588
Monoisotopic Mass500.24102
SMILESCCCCCC(=O)Cc1cc(OC)cc(O)c1C(=O)Oc1cc(CCCCC)c(C(=O)O)c(OC)c1
InChIInChI=1S/C28H36O8/c1-5-7-9-11-18-14-22(17-24(35-4)26(18)27(31)32)36-28(33)25-19(13-20(29)12-10-8-6-2)15-21(34-3)16-23(25)30/h14-17,30H,5-13H2,1-4H3,(H,31,32)
InChIKeyUANVCGQMNRTKGM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Confluentic acid (CHEBI:144140) is a carbonyl compound (CHEBI:36586)