input word = C00021287

Metabolite InformationStructural formula
Name Patchoulenone
8-Oxocyperene
Formula C15H22O
Mw 218.16706532
CAS RN 5986-54-9
C_ID C00021287 ,
InChIKey JAWSHISYWRRQQQ-LBWFPZMQNA-N
InChICode InChI=1S/C15H22O/c1-9-7-8-15-10(2)5-6-11(14(15,3)4)13(16)12(9)15/h10-11H,5-8H2,1-4H3/t10-,11-,15+/m1/s1
SMILES CC1=C2C(=O)[C@H]3CC[C@@H](C)[C@]2(CC1)C3(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCyperaceaeCyperus rotundus Ref.
PlantaeCyperaceaeCyperus scariosus Ref.
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