input word = C00046766

Metabolite InformationStructural formula
Name Hexylitaconic acid
Formula C11H18O4
Mw 214.12050906
CAS RN 111430-51-4
C_ID C00046766 ,
InChIKey HKMDCNSGDQBQLI-UHFFFAOYNA-N
InChICode InChI=1S/C11H18O4/c1-3-4-5-6-7-9(11(14)15)8(2)10(12)13/h9H,2-7H2,1H3,(H,12,13)(H,14,15)/t9-/m1/s1
SMILES C(=O)(C(=C)[C@H](C(=O)O)CCCCCC)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiTrichocomaceaeAspergillus niger Ref.
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