input word = C00042723

Metabolite InformationStructural formula
Name Medicosmine
Formula C17H15NO3
Mw 281.10519335
CAS RN 35306-86-6
C_ID C00042723 ,
InChIKey WVBLHNOAFTUBSS-UHFFFAOYSA-N
InChICode InChI=1S/C17H15NO3/c1-17(2)8-6-10-13(21-17)5-4-12-14(10)15(19-3)11-7-9-20-16(11)18-12/h4-9H,1-3H3
SMILES c12c(ccc3c1C=CC(O3)(C)C)nc1c(c2OC)cco1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Ala
Organism
Kingdom Family Species Reference
PlantaeRutaceaeBoronella koniambiensis Ref.
PlantaeRutaceaeMedicosma cunninghamii Hook.f. Ref.
--Medicosmacunninghamii Ref.
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