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CHEBI:144291 - Planaic acid

Default Structure
ChEBI IDCHEBI:144291
ChEBI NamePlanaic acid
Stars
Submittermwilliams
DownloadsMolfile
FormulaC27H36O7
Net Charge0
Average Mass472.578
Monoisotopic Mass472.24610
SMILESCCCCCc1cc(OC(=O)c2c(CCCCC)cc(OC)cc2OC)cc(OC)c1C(=O)O
InChIInChI=1S/C27H36O7/c1-6-8-10-12-18-15-21(17-22(32-4)24(18)26(28)29)34-27(30)25-19(13-11-9-7-2)14-20(31-3)16-23(25)33-5/h14-17H,6-13H2,1-5H3,(H,28,29)
InChIKeyFNJKTDQIJKLZGZ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Planaic acid (CHEBI:144291) is a carbonyl compound (CHEBI:36586)