input word = C00062515

Metabolite InformationStructural formula
Name 1-Nitropentane
Formula C5H11NO2
Mw 117.0789786
CAS RN 628-05-7
C_ID C00062515
InChIKey BVALZCVRLDMXOQ-UHFFFAOYSA-N
InChICode InChI=1S/C5H11NO2/c1-2-3-4-5-6(7)8/h2-5H2,1H3
SMILES CCCCC[N+](=O)[O-]
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeSolanum lycopersicum Ref.
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OrganismSolanum lycopersicum
Referencehttps://doi.org/10.1016/S0308-8146(00)00187-4

https://doi.org/10.1016/j.talanta.2008.07.061

https://doi.org/10.5935/0103-5053.20160142