input word = C00004952

Metabolite InformationStructural formula
Name 6-Hydroxykaempferol 3-methyl ether 7-O-sulfate
Formula C16H12O10S
Mw 396.01511734
CAS RN 78876-28-5
C_ID C00004952 ,
InChIKey KDVOBVBPKCRDQE-UHFFFAOYSA-N
InChICode InChI=1S/C16H12O10S/c1-24-16-14(20)11-9(25-15(16)7-2-4-8(17)5-3-7)6-10(12(18)13(11)19)26-27(21,22)23/h2-6,17-19H,1H3,(H,21,22,23)
SMILES c1(c(c(c2c(c1)oc(c(c2=O)OC)c1ccc(cc1)O)O)O)OS(=O)(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeNeurolaena lobata Ref.
zoom in