input word = C00021113

Metabolite InformationStructural formula
Name 2-[4-Methyl-2-(2-methylpropoxy)phenyl]-oxiranemethanol acetate
Formula C16H22O4
Mw 278.15180919
CAS RN 88010-80-4
C_ID C00021113 ,
InChIKey FBZJTDYUBDAZIH-UHFFFAOYNA-N
InChICode InChI=1S/C16H22O4/c1-11(2)8-18-15-7-12(3)5-6-14(15)16(10-20-16)9-19-13(4)17/h5-7,11H,8-10H2,1-4H3/t16-/m1/s1
SMILES c1(ccc(c(c1)OCC(C)C)[C@]1(CO1)COC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeBrasilia sickii Ref.
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