input word = C00020354

Metabolite InformationStructural formula
Name Cyclokessyl acetate
Formula C17H26O3
Mw 278.1881947
CAS RN 103223-36-5
C_ID C00020354 ,
InChIKey PYBLHVQRTQABFU-MNZINTHMNA-N
InChICode InChI=1S/C17H26O3/c1-8-6-11(19-9(2)18)15-12(8)13-10-7-17(15,5)20-16(3,4)14(10)13/h8,10-15H,6-7H2,1-5H3/t8-,10-,11-,12+,13-,14-,15-,17+/m1/s1
SMILES [C@@H]12[C@H]([C@]3(OC([C@H]4[C@@H]1[C@H]4C3)(C)C)C)[C@@H](C[C@H]2C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeValerianaceae/Linnaeaceae/Dipsacaceae/DiervillaceaeValeriana fauriei Ref.
zoom in



OrganismValeriana fauriei
ReferenceOshima,Tetrahedron Lett.,27,(1986),1829