input word = C00004682

Metabolite InformationStructural formula
Name Quercetagetin 3'-methyl ether
Formula C16H12O8
Mw 332.05321736
CAS RN 57093-48-8
C_ID C00004682 ,
InChIKey APUSTZNOWHEAEP-UHFFFAOYSA-N
InChICode InChI=1S/C16H12O8/c1-23-9-4-6(2-3-7(9)17)16-15(22)14(21)11-10(24-16)5-8(18)12(19)13(11)20/h2-5,17-20,22H,1H3
SMILES c1(c(c(c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)OC)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeAnacyclus spp. Ref.
PlantaeAsteraceaeCentaurea spp. Ref.
PlantaeAsteraceaeChrysanthemum coronarium Ref.
PlantaeAsteraceaeClibadium spp. Ref.
PlantaeAsteraceaeEupatorium tinifolium Ref.
PlantaeAsteraceaeLepidophorum spp. Ref.
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