input word = C00052350

Metabolite InformationStructural formula
Name Methylsuccinic acid
Formula C5H8O4
Mw 132.04225874
CAS RN 498-21-5
C_ID C00052350
InChIKey WXUAQHNMJWJLTG-UHFFFAOYSA-N
InChICode InChI=1S/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)
SMILES OC(C(C)CC(O)=O)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
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