input word = C00052391

Metabolite InformationStructural formula
Name Ptelefolidine
Formula C17H19NO5
Mw 317.12632272
CAS RN 27745-40-0
C_ID C00052391
InChIKey KWKLMCSZRFVKJI-UHFFFAOYSA-N
InChICode InChI=1S/C17H19NO5/c1-9(2)12(19)7-11-15(21-4)10-5-6-13-16(23-8-22-13)14(10)18(3)17(11)20/h5-6,12,19H,1,7-8H2,2-4H3
SMILES C=C(C)C(O)Cc1c(OC)c2ccc3c(c2n(C)c1=O)OCO3
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRutaceaePtelea trifoliata Ref.
PlantaeRutaceaePtelea trifoliata ssp. Pallida var. confinis Ref.
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OrganismPtelea trifoliata ssp. Pallida var. confinis
ReferenceNatural Products Vol.1 ISBN978-3-642-22143-9