input word = C00010280

Metabolite InformationStructural formula
Name 3-Methyl-2-butenoic acid
Formula C5H8O2
Mw 100.0524295
CAS RN 541-47-9
C_ID C00010280 ,
InChIKey YYPNJNDODFVZLE-UHFFFAOYSA-N
InChICode InChI=1S/C5H8O2/c1-4(2)3-5(6)7/h3H,1-2H3,(H,6,7)
SMILES C(=C(C)C)C(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaePeucedanum japonicum Ref.
--Caffea sp. Ref.
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OrganismCaffea sp.
Referencehttps://doi.org/10.1016/j.foodchem.2018.08.068

https://doi.org/10.1016/j.lwt.2016.11.047