input word = C00055455

Metabolite InformationStructural formula
Name 5-Chloro-5-cyanobicyclo[2.2.2]octan-2-one
Formula C9H10ClNO
Mw 183.04509166
CAS RN 1214723-42-8
C_ID C00055455
InChIKey HKWFXVQNIAEGAT-UHFFFAOYSA-N
InChICode InChI=1S/C9H10ClNO/c10-9(5-11)4-6-1-2-7(9)3-8(6)12/h6-7H,1-4H2
SMILES O=C1CC2C(C#N)(Cl)CC1CC2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePhyllanthaceaePhyllanthus emblica Ref.
zoom in