RefMet Compound Details

RefMet IDRM0135211
MW structure22240 (View MW Metabolite Database details)
RefMet nameDemethyltexasin
Systematic name6,7-dihydroxy-3-(4-hydroxyphenyl)chromen-4-one
SMILESc1cc(ccc1c1coc2cc(c(cc2c1=O)O)O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass270.052825 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC15H10O5View other entries in RefMet with this formula
InChIInChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)11-7-20-14-6-13(18)12(17)5-10(14)15(11)19/h1-7,16-18H
InChIKeyGYLUFQJZYAJQDI-UHFFFAOYSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassPolyketides
Main ClassFlavonoids
Sub ClassIsoflavonoids
Pubchem CID5284649
ChEBI ID74957
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
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