input word = C00052634

Metabolite InformationStructural formula
Name 2-Ethylcyclohexanone
Formula C8H14O
Mw 126.10446507
CAS RN 4423-94-3
C_ID C00052634
InChIKey WKYYYUWKFPFVEY-UHFFFAOYSA-N
InChICode InChI=1S/C8H14O/c1-2-7-5-3-4-6-8(7)9/h7H,2-6H2,1H3
SMILES O=C1C(CC)CCCC1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeRosmarinus officinalis Ref.
PlantaeSolanaceaeMandragora autumnalis Ref.
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OrganismRosmarinus officinalis
ReferenceMena, P. et al., Molecules, 21, (2016), 1576