input word = C00008246

Metabolite InformationStructural formula
Name Isoxanthohumol
Isoxanthohumol(Sophora)
Formula C21H22O5
Mw 354.14672381
CAS RN 70872-29-6
C_ID C00008246 ,
InChIKey YKGCBLWILMDSAV-UHFFFAOYNA-N
InChICode InChI=1S/C21H22O5/c1-12(2)4-9-15-16(23)10-19(25-3)20-17(24)11-18(26-21(15)20)13-5-7-14(22)8-6-13/h4-8,10,18,22-23H,9,11H2,1-3H3/t18-/m1/s1
SMILES c1(cc(c2c(c1CC=C(C)C)O[C@H](CC2=O)c1ccc(cc1)O)OC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeHumulus lupulus Ref.
PlantaeFabaceaeSophora angustifolia Ref.
PlantaeFabaceaeSophora flavescens Ref.
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OrganismHumulus lupulus
ReferenceEdited by Jiangsu New Medicinal College, Chinese Medicine Dictionary, Shanghai Science and technology Press, Shanghai, (1979).

Lu, et al., Chinese Traditional and Herbal Drugs(Zhongcaoyao), 33, (2002), 563.

Chadwick, et al., Journal of Natural Products, 67, (2004), 2024