input word = C00012456

Metabolite InformationStructural formula
Name Juferin
Formula C22H28O3
Mw 340.20384476
CAS RN 70629-76-4
C_ID C00012456 ,
InChIKey AWLPVLIAJCOYIW-NYEADEDXNA-N
InChICode InChI=1S/C22H28O3/c1-16-6-5-7-17(2)14-20(15-22(3,4)13-12-16)25-21(24)18-8-10-19(23)11-9-18/h7-13,20,23H,1,5-6,14-15H2,2-4H3/b13-12-,17-7+/t20-/m0/s1
SMILES C\1(=C/CCC(=C)/C=C\C(C[C@H](C1)OC(=O)c1ccc(cc1)O)(C)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula juniperina Ref.
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