input word = C00052394

Metabolite InformationStructural formula
Name Ptelefructine
Formula C18H21NO6
Mw 347.13688741
CAS RN 27741-35-1
C_ID C00052394
InChIKey VODIVYWIORQEPM-UHFFFAOYSA-N
InChICode InChI=1S/C18H21NO6/c1-9(2)12(20)6-11-15(22-4)10-7-13-16(25-8-24-13)17(23-5)14(10)19(3)18(11)21/h7,12,20H,1,6,8H2,2-5H3
SMILES C=C(C)C(O)Cc1c(OC)c2cc3c(c(OC)c2n(C)c1=O)OCO3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaePtelea trifoliata Ref.
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OrganismPtelea trifoliata
ReferenceNatural Products Vol.1 ISBN978-3-642-22143-9