input word = C00040052

Metabolite InformationStructural formula
Name Populene C
(-)-Populene C
Formula C18H20O3
Mw 284.1412445
CAS RN 1035531-17-9
C_ID C00040052 ,
InChIKey LKKQCDCZGYUJTA-UHFFFAOYNA-N
InChICode InChI=1S/C18H20O3/c1-9-7-13-14(11(3)8-21-18(13,4)5)12-6-10(2)16(19)17(20)15(9)12/h6-7,11H,8H2,1-5H3/t11-/m1/s1
SMILES CC1=Cc2c(c(C)cc3c2C(C)COC3(C)C)C(=O)C1=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeMalvaceaeThespesia populnea L.Soland.Ex Coor Ref.
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