input word = C00011626

Metabolite InformationStructural formula
Name 2-Methyl-6-(4-methylphenyl)-1-hepten-3-one
1,3,5,11-Bisabolatetraen-10-one
Formula C15H20O
Mw 216.15141526
CAS RN 86981-84-2
C_ID C00011626 ,
InChIKey JVRYIUOXNFDSNU-UHFFFAOYNA-N
InChICode InChI=1S/C15H20O/c1-11(2)15(16)10-7-13(4)14-8-5-12(3)6-9-14/h5-6,8-9,13H,1,7,10H2,2-4H3/t13-/m0/s1
SMILES c1cc(ccc1C)[C@@H](C)CCC(=O)C(=C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLauraceaeCinnamomum cassia Ref.
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OrganismCinnamomum cassia
ReferenceTerhune,Can.J.Chem.,53,(1975),3285

Thomas, A.F.Helv. Chim. Acta, 1980, 63, 1615 (isol, struct, ms, synth)