input word = C00035501

Metabolite InformationStructural formula
Name 4-Heptanone
Formula C7H14O
Mw 114.10446507
CAS RN 123-19-3
C_ID C00035501 ,
InChIKey HCFAJYNVAYBARA-UHFFFAOYSA-N
InChICode InChI=1S/C7H14O/c1-3-5-7(8)6-4-2/h3-6H2,1-2H3
SMILES CCCC(=O)CCC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
PlantaeAnacardiaceaeMangifera indica Ref.
PlantaeCaricaceaeCarica papaya Ref.
PlantaePoaceaeCapillipedium parviflorum Ref.
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OrganismCapillipedium parviflorum
ReferenceMahmood,Phytochem.,65,(2004),2163