input word = C00055162

Metabolite InformationStructural formula
Name 3,5-Bis(3-methyl-2-butenyl)phlorisovalerophenone
Formula C21H30O4
Mw 346.21440945
CAS RN 4374-93-0
C_ID C00055162
InChIKey NQYBQBZOHCACCR-UHFFFAOYSA-N
InChICode InChI=1S/C21H30O4/c1-12(2)7-9-15-19(23)16(10-8-13(3)4)21(25)18(20(15)24)17(22)11-14(5)6/h7-8,14,23-25H,9-11H2,1-6H3
SMILES C/C(C)=CCC1=C(O)C(C/C=C(C)C)=C(O)C(C(CC(C)C)=O)=C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCannabaceaeHumulus lupulus Ref.
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