input word = C00040826

Metabolite InformationStructural formula
Name 4-(3-Methyl-2-butenoxy)isonitrosoacetophenone
Formula C13H15NO3
Mw 233.10519335
CAS RN 143797-41-5
C_ID C00040826 ,
InChIKey DIKOBVULVNJCCO-NTEUORMPSA-N
InChICode InChI=1S/C13H15NO3/c1-10(2)7-8-17-12-5-3-11(4-6-12)13(15)9-14-16/h3-7,9,16H,8H2,1-2H3/b14-9+
SMILES c1c(ccc(c1)C(=O)/C=N/O)OCC=C(C)C
Start Substs in Alk. Biosynthesis (Prediction) L-Tyr
Organism
Kingdom Family Species Reference
PlantaeRutaceaeCitrus sinensis cv.Valencia Ref.
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OrganismCitrus sinensis cv.Valencia
ReferenceDubery,Phytochem.,50,(1999),983