input word = C00035708

Metabolite InformationStructural formula
Name Officinalin isobutyrate
Formula C15H14O6
Mw 290.07903818
CAS RN 61467-56-9
C_ID C00035708 ,
InChIKey VUVWVGLISBHUCV-UHFFFAOYSA-N
InChICode InChI=1S/C15H14O6/c1-8(2)14(17)21-12-7-11-9(4-5-13(16)20-11)6-10(12)15(18)19-3/h4-8H,1-3H3
SMILES c12c(ccc(=O)o1)cc(c(c2)OC(=O)C(C)C)C(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePeucedanum tauricum Ref.
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