input word = C00007099

Metabolite InformationStructural formula
Name Xanthohumol
Formula C21H22O5
Mw 354.14672381
CAS RN 569-83-5
C_ID C00007099 ,
InChIKey ORXQGKIUCDPEAJ-YRNVUSSQSA-N
InChICode InChI=1S/C21H22O5/c1-13(2)4-10-16-18(24)12-19(26-3)20(21(16)25)17(23)11-7-14-5-8-15(22)9-6-14/h4-9,11-12,22,24-25H,10H2,1-3H3/b11-7+
SMILES c1c(ccc(c1)O)/C=C/C(=O)c1c(cc(c(c1O)CC=C(C)C)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeHumulus lupulus Ref.
PlantaeFabaceaeSophora angustifolia Ref.
PlantaeFabaceaeSophora flavescens Ref.
zoom in