input word = C00046757

Metabolite InformationStructural formula
Name Graveolinine
Formula C17H13NO3
Mw 279.08954329
CAS RN 4179-37-7
C_ID C00046757 ,
InChIKey QGCORDIPOBZNKC-UHFFFAOYSA-N
InChICode InChI=1S/C17H13NO3/c1-19-16-9-14(18-13-5-3-2-4-12(13)16)11-6-7-15-17(8-11)21-10-20-15/h2-9H,10H2,1H3
SMILES COc1cc(-c2ccc3c(c2)OCO3)nc2ccccc12
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeRutaceaeLunasia amara Ref.
PlantaeRutaceaeRuta chalepensis Ref.
PlantaeRutaceaeRuta graveolens Ref.
PlantaeRutaceaeRuta graveolensis Ref.
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