input word = C00002753

Metabolite InformationStructural formula
Name Isosafrole
Formula C10H10O2
Mw 162.06807956
CAS RN 120-58-1
C_ID C00002753 ,
InChIKey VHVOLFRBFDOUSH-NSCUHMNNSA-N
InChICode InChI=1S/C10H10O2/c1-2-3-8-4-5-9-10(6-8)12-7-11-9/h2-6H,7H2,1H3/b3-2+
SMILES c12c(ccc(c1)/C=C/C)OCO2
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeCananga odorata Ref.
PlantaeApiaceaeAngelica acutiloba Ref.
PlantaeApiaceaeLigusticum acutilobum Ref.
PlantaeIlliciaceaeIllicium religiosum Ref.
PlantaeRutaceaeMurraya koenigii Ref.
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OrganismMurraya koenigii
ReferenceHarborne,Phytochemical Dictionary Second Edition,Taylor and Francis,(1999),Chapter42