input word = C00049006

Metabolite InformationStructural formula
Name Hexane
n-Hexane
Formula C6H14
Mw 86.10955045
CAS RN 110-54-3
C_ID C00049006 ,
InChIKey VLKZOEOYAKHREP-UHFFFAOYSA-N
InChICode InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3
SMILES CCCCCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiBoletaceaeBoletus edulis Ref.
FungiPolyporaceaeLentinus edodes Ref.
PlantaeCaricaceaeCarica papaya Ref.
PlantaeMalvaceaeSida galheirensis Ref.
PlantaeOleaceaeOlea europaea Ref.
PlantaePolygonaceaeRumex thyrsiflorus Ref.
PlantaeRutaceaeCitrus aurantifolia Ref.
--Caffea sp. Ref.
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OrganismLentinus edodes
ReferenceAldrich Library of FT-IR Spectra,1st edn.,1,(1985),1B