input word = C00060616

Metabolite InformationStructural formula
Name 5-Methylhexanenitrile
Formula C7H13N
Mw 111.10479942
CAS RN 19424-34-1
C_ID C00060616
InChIKey CHWIKAJVZUSSML-UHFFFAOYSA-N
InChICode InChI=1S/C7H13N/c1-7(2)5-3-4-6-8/h7H,3-5H2,1-2H3
SMILES CC(C)CCCC#N
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeCapsella bursa-pastoris Ref.
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OrganismCapsella bursa-pastoris
Referencehttps://doi.org/10.13386/j.issn1002-0306.2015.15.033

https://doi.org/10.13982/j.mfst.1673-9078.2015.8.036