input word = C00061061

Metabolite InformationStructural formula
Name 12-Methyl-nonacosanoic acid
Formula C30H60O2
Mw 452.45933116
CAS RN 2488762-22-5
C_ID C00061061
InChIKey XIEMUZURCSJHQJ-UHFFFAOYSA-N
InChICode InChI=1S/C30H60O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-17-20-23-26-29(2)27-24-21-18-15-16-19-22-25-28-30(31)32/h29H,3-28H2,1-2H3,(H,31,32)
SMILES CCCCCCCCCCCCCCCCCC(C)CCCCCCCCCCC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeTriticum aestivum Ref.
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