input word = C00012457

Metabolite InformationStructural formula
Name Ferocin
Formula C22H28O3
Mw 340.20384476
CAS RN 65638-03-1
C_ID C00012457 ,
InChIKey AWLPVLIAJCOYIW-FECYYMEJNA-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-/m1/s1
SMILES C=C1/C=C/C(C)(C)CC(OC(=O)c2ccc(O)cc2)C/C(C)=C/CC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeFerula ceratophylla Ref.
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