input word = C00014472

Metabolite InformationStructural formula
Name Xanthohumol D
3'-(2-Hydroxy-3-methylbutyl-3-enyl)-4,2',4'-trihydroxy-6'-methoxychalcone
Formula C21H22O6
Mw 370.14163844
CAS RN 274675-25-1
C_ID C00014472 ,
InChIKey IIWLGOCXDBSFCM-RMKNXTFCNA-N
InChICode InChI=1S/C21H22O6/c1-12(2)17(24)10-15-18(25)11-19(27-3)20(21(15)26)16(23)9-6-13-4-7-14(22)8-5-13/h4-9,11,17,22,24-26H,1,10H2,2-3H3/b9-6+/t17-/m1/s1
SMILES c1c(c(c(c(c1OC)C(=O)/C=C/c1ccc(cc1)O)O)C[C@@H](O)C(=C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeHumulus lupulus Ref.
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