input word = C00004954

Metabolite InformationStructural formula
Name Eupalitin 3-O-sulfate
Formula C17H14O10S
Mw 410.0307674
CAS RN 111316-16-6
C_ID C00004954 ,
InChIKey YLELFVGSHOFEAD-UHFFFAOYSA-N
InChICode InChI=1S/C17H14O10S/c1-24-11-7-10-12(13(19)16(11)25-2)14(20)17(27-28(21,22)23)15(26-10)8-3-5-9(18)6-4-8/h3-7,18-19H,1-2H3,(H,21,22,23)
SMILES COc1cc2oc(-c3ccc(O)cc3)c(OS(=O)(=O)O)c(=O)c2c(O)c1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBrickellia longifolia Ref.
PlantaeAsteraceaeFlaveria chloraefolia Ref.
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OrganismFlaveria chloraefolia
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 181.Flavonols

Borron,Phytochem.,29,(1987),2085