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CHEBI:144191 - Physodic acid

Default Structure
ChEBI IDCHEBI:144191
ChEBI NamePhysodic acid
Stars
Submittermwilliams
DownloadsMolfile
FormulaC26H30O8
Net Charge0
Average Mass470.518
Monoisotopic Mass470.19407
SMILESCCCCCC(=O)Cc1cc(O)cc2c1C(=O)Oc1cc(O)c(C(=O)O)c(CCCCC)c1O2
InChIInChI=1S/C26H30O8/c1-3-5-7-9-16(27)11-15-12-17(28)13-20-22(15)26(32)34-21-14-19(29)23(25(30)31)18(24(21)33-20)10-8-6-4-2/h12-14,28-29H,3-11H2,1-2H3,(H,30,31)
InChIKeyKVTYWHGIZSCFLG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Physodic acid (CHEBI:144191) is a carbonyl compound (CHEBI:36586)