input word = C00059006

Metabolite InformationStructural formula
Name trans-[12]-Shogaol
Formula C23H36O3
Mw 360.26644502
CAS RN 104264-52-0
C_ID C00059006
InChIKey WCQFXNQALHURHS-BUHFOSPRSA-N
InChICode InChI=1S/C23H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-21(24)17-15-20-16-18-22(25)23(19-20)26-2/h13-14,16,18-19,25H,3-12,15,17H2,1-2H3/b14-13+
SMILES CCCCCCCCCCCC=CC(=O)CCc1ccc(O)c(OC)c1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeZingiberaceaeZingiber officinale Ref.
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