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CHEBI:144109 - Alpha-Alectoronic acid

Default Structure
ChEBI IDCHEBI:144109
ChEBI NameAlpha-Alectoronic acid
Stars
Submittermwilliams
DownloadsMolfile
FormulaC28H32O9
Net Charge0
Average Mass512.555
Monoisotopic Mass512.20463
SMILESCCCCCC(=O)Cc1cc(O)cc2c1C(=O)Oc1cc(O)c(C(=O)O)c(CC(=O)CCCCC)c1O2
InChIInChI=1S/C28H32O9/c1-3-5-7-9-17(29)11-16-12-19(31)14-22-24(16)28(35)37-23-15-21(32)25(27(33)34)20(26(23)36-22)13-18(30)10-8-6-4-2/h12,14-15,31-32H,3-11,13H2,1-2H3,(H,33,34)
InChIKeyZDIOCINAHISORH-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Alpha-Alectoronic acid (CHEBI:144109) is a carbonyl compound (CHEBI:36586)