input word = C00021829

Metabolite InformationStructural formula
Name beta-Isocomene
Formula C15H24
Mw 204.18780077
CAS RN 74311-15-2
C_ID C00021829 ,
InChIKey KPKLYXVMHOVJJL-AIKOOUTPNA-N
InChICode InChI=1S/C15H24/c1-11-6-9-14(4)12(2)10-13(3)7-5-8-15(11,13)14/h11H,2,5-10H2,1,3-4H3/t11-,13+,14+,15-/m0/s1
SMILES C1C[C@]2([C@@]3(C1)[C@@](C(=C)C2)(CC[C@@H]3C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeArtemisia annua L.cultivar Jwarharti Ref.
PlantaeAsteraceaeBerkheya spp. Ref.
PlantaeAsteraceaePetasites albus Ref.
PlantaeAsteraceaePetasites hybridus Ref.
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OrganismPetasites albus
ReferenceFriscis, M. et al., Chem. Biodiv., 16, (2019), e1800531.