input word = C00053588

Metabolite InformationStructural formula
Name 1-Octen-3-yl acetate
Octen-3-yl acetate
FEMA 3582
Formula C10H18O2
Mw 170.13067982
CAS RN 2442-10-6
C_ID C00053588
InChIKey DOJDQRFOTHOBEK-UHFFFAOYSA-N
InChICode InChI=1S/C10H18O2/c1-4-6-7-8-10(5-2)12-9(3)11/h5,10H,2,4,6-8H2,1,3H3
SMILES C=CC(CCCCC)OC(C)=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeApium graveolens Ref.
PlantaeLabiataeLavandula angustifolia Ref.
PlantaeLabiataeMentha spp. Ref.
PlantaeLabiataeOcimum basilicum Ref.
--Lavandin abrialis Ref.
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OrganismApium graveolens
Referencehttps://doi.org/10.1080/10412905.2002.9699852