input word = C00010831

Metabolite InformationStructural formula
Name Diester with 4-(1,2-epoxy-1-methylethyl)-3-hydroxybenzyl alc. isobutyric acid
Formula C18H24O5
Mw 320.16237388
CAS RN 22571-39-7
C_ID C00010831 ,
InChIKey LVMMNKQZLWLOIL-UHFFFAOYNA-N
InChICode InChI=1S/C18H24O5/c1-11(2)16(19)21-9-13-6-7-14(18(5)10-22-18)15(8-13)23-17(20)12(3)4/h6-8,11-12H,9-10H2,1-5H3/t18-/m0/s1
SMILES CC(C)C(=O)OCc1ccc(C2(C)CO2)c(OC(=O)C(C)C)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGaillardia aristata Ref.
PlantaeAsteraceaeHelenium spp. Ref.
zoom in