input word = C00030108

Metabolite InformationStructural formula
Name Demethylsuberosin
7-Demethylsuberosin
Formula C14H14O3
Mw 230.09429431
CAS RN 21422-04-8
C_ID C00030108 ,
InChIKey RMABDUZOGNTCQA-UHFFFAOYSA-N
InChICode InChI=1S/C14H14O3/c1-9(2)3-4-10-7-11(15)8-13-12(10)5-6-14(16)17-13/h3,5-8,15H,4H2,1-2H3
SMILES c12c(ccc(=O)o1)c(cc(c2)O)CC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus paradisi Ref.
PlantaeRutaceaeFeronia limonia Ref.
PlantaeRutaceaePhellodendron amurense Ref.
zoom in



OrganismCitrus paradisi
ReferenceHung, W. L. et al., J. Food Drug Anal., 25, (2017), 71-83.