input word = C00022703

Metabolite InformationStructural formula
Name 2-Isovaleroyl-4-[1-hydroxyethyl]-phenol
Formula C13H18O3
Mw 222.12559444
CAS RN 101622-92-8
C_ID C00022703 ,
InChIKey AWFXQEZPCZDBIE-UHFFFAOYNA-N
InChICode InChI=1S/C13H18O3/c1-8(2)6-13(16)11-7-10(9(3)14)4-5-12(11)15/h4-5,7-9,14-15H,6H2,1-3H3/t9-/m0/s1
SMILES CC(C)CC(=O)c1cc(C(C)O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBrachyclados megalanthus Ref.
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