input word = C00014474

Metabolite InformationStructural formula
Name Xanthohumol E
3'-Prenyl-6'',6''-dimethylpyrano[2'',3'':6',5']-4,2',4'-trihydroxychalcone
Formula C25H26O5
Mw 406.17802394
CAS RN 274675-26-2
C_ID C00014474 ,
InChIKey KRZGSPKDWYNTHE-XYOKQWHBSA-N
InChICode InChI=1S/C25H26O5/c1-15(2)5-11-18-22(28)19-13-14-25(3,4)30-24(19)21(23(18)29)20(27)12-8-16-6-9-17(26)10-7-16/h5-10,12-14,26,28-29H,11H2,1-4H3/b12-8+
SMILES c1(c(c(c2c(c1C(=O)/C=C/c1ccc(cc1)O)OC(C=C2)(C)C)O)CC=C(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeHumulus lupulus Ref.
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OrganismHumulus lupulus
ReferenceStevens,Phytochem.,53,(2000),759