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CHEBI:2883 - Aspidin

ChEBI IDCHEBI:2883
ChEBI NameAspidin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC25H32O8
Net Charge0
Average Mass460.523
Monoisotopic Mass460.20972
SMILESCCCC(=O)C1=C(O)C(C)(C)C(O)=C(Cc2c(O)c(C)c(OC)c(C(=O)CCC)c2O)C1=O
InChIInChI=1S/C25H32O8/c1-7-9-15(26)17-20(29)13(19(28)12(3)22(17)33-6)11-14-21(30)18(16(27)10-8-2)24(32)25(4,5)23(14)31/h28-29,31-32H,7-11H2,1-6H3
InChIKeyDCEHSZHMKGBNHS-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Aspidin (CHEBI:2883) has functional parent phloroglucinol (CHEBI:16204)
Aspidin (CHEBI:2883) is a carboxylic ester (CHEBI:33308)
Synonym  Source
AspidinKEGG COMPOUND
Manual XrefsDatabases
C10672KEGG COMPOUND
C00002690KNApSAcK
Registry NumbersSources
CAS:584-28-1KEGG COMPOUND