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CHEBI:175185 - Asacoumarin A

ChEBI IDCHEBI:175185
ChEBI NameAsacoumarin A
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FormulaC24H30O5
Net Charge0
Average Mass398.499
Monoisotopic Mass398.20932
SMILESCC(C)=CCC(O)/C(C)=C/C(O)C/C(C)=C/COc1ccc2ccc(=O)oc2c1
InChIInChI=1S/C24H30O5/c1-16(2)5-9-22(26)18(4)14-20(25)13-17(3)11-12-28-21-8-6-19-7-10-24(27)29-23(19)15-21/h5-8,10-11,14-15,20,22,25-26H,9,12-13H2,1-4H3/b17-11+,18-14+
InChIKeyNFXNEAJDYTXPLG-CBXDKUCNSA-N
ChEBI Ontology
Outgoing Relation(s)
Asacoumarin A (CHEBI:175185) is a terpene lactone (CHEBI:37668)
IUPAC Name 
7-[(2E,6E)-5,8-dihydroxy-3,7,11-trimethyldodeca-2,6,10-trienoxy]chromen-2-one
Manual XrefsDatabases
24691879ChemSpider