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CHEBI:175387 - Isoangustone A

ChEBI IDCHEBI:175387
ChEBI NameIsoangustone A
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FormulaC25H26O6
Net Charge0
Average Mass422.477
Monoisotopic Mass422.17294
SMILESCC(C)=CCc1cc(-c2coc3cc(O)c(CC=C(C)C)c(O)c3c2=O)cc(O)c1O
InChIInChI=1S/C25H26O6/c1-13(2)5-7-15-9-16(10-20(27)23(15)28)18-12-31-21-11-19(26)17(8-6-14(3)4)24(29)22(21)25(18)30/h5-6,9-12,26-29H,7-8H2,1-4H3
InChIKeyQNLGNISMYMFVHP-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Isoangustone A (CHEBI:175387) is a isoflavanones (CHEBI:38741)
IUPAC Name 
3-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-5,7-dihydroxy-6-(3-methylbut-2-enyl)chromen-4-one
Manual XrefsDatabases
10211375ChemSpider
HMDB0038905HMDB
LMPK12050243LIPID MAPS