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CHEBI:144309 - Umbilicaric acid

Default Structure
ChEBI IDCHEBI:144309
ChEBI NameUmbilicaric acid
Stars
Submittermwilliams
DownloadsMolfile
FormulaC25H22O10
Net Charge0
Average Mass482.441
Monoisotopic Mass482.12130
SMILESCOc1cc(O)cc(C)c1C(=O)Oc1cc(C)c(C(=O)Oc2cc(C)c(C(=O)O)c(O)c2)c(O)c1
InChIInChI=1S/C25H22O10/c1-11-5-14(26)8-19(33-4)22(11)25(32)35-16-7-13(3)21(18(28)10-16)24(31)34-15-6-12(2)20(23(29)30)17(27)9-15/h5-10,26-28H,1-4H3,(H,29,30)
InChIKeyRLRCNRNYRSKNOO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Umbilicaric acid (CHEBI:144309) is a carbonyl compound (CHEBI:36586)