input word = C00062201

Metabolite InformationStructural formula
Name 11,14,17-Eicosatrienoic acid methyl ester
Formula C21H36O2
Mw 320.27153039
CAS RN 55682-88-7
C_ID C00062201
InChIKey XQAVRBUXEPJVRC-UHFFFAOYSA-N
InChICode InChI=1S/C21H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-2/h4-5,7-8,10-11H,3,6,9,12-20H2,1-2H3/b5-4+,8-7+,11-10+
SMILES CCC=CCC=CCC=CCCCCCCCCCC(=O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeNicotiana tabacum Ref.
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