input word = C00051539

Metabolite InformationStructural formula
Name Mesaconic acid
Formula C5H6O4
Mw 130.02660868
CAS RN 498-24-8
C_ID C00051539
InChIKey AKODIDWEFYTFHX-GORDUTHDSA-N
InChICode InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/b3-2+
SMILES C/C(=COC=O)OC=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaePoaceaeSaccharum sinensis Ref.
PlantaeSolanaceaeSolanum tuberosum Ref.
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OrganismSolanum tuberosum
ReferenceDrapal, M. et al., Phytochemistry, 135, (2017), 24-33.