input word = C00054006

Metabolite InformationStructural formula
Name 1-Octene
Caprylene
Formula C8H16
Mw 112.12520051
CAS RN 111-66-0
C_ID C00054006
InChIKey KWKAKUADMBZCLK-UHFFFAOYSA-N
InChICode InChI=1S/C8H16/c1-3-5-7-8-6-4-2/h3H,1,4-8H2,2H3
SMILES C=CCCCCCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiAgaricaceaeCalvatia gigantea Ref.
PlantaePoaceaeOryza sativa Ref.
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OrganismCalvatia gigantea
ReferenceAldrich Library of FT-IR Spectra, 1st edn.,1985, 1, 14A (ir)