input word = C00051762

Metabolite InformationStructural formula
Name Senecionine N-oxide
Formula C18H25NO6
Mw 351.16818754
CAS RN 13268-67-2
C_ID C00051762
InChIKey
InChICode InChI=1S/C18H26NO6/c1-4-12-9-11(2)18(3,22)17(21)24-10-13-5-7-19(23)8-6-14(15(13)19)25-16(12)20/h4-5,11,14-15,22-23H,6-10H2,1-3H3/b12-4-/t11-,14-,15-,18-/m1/s1
SMILES [C@H]12[N]3(CC[C@H]1OC(=O)/C(=C\C)/C[C@H]([C@@](C(=O)OCC2=CC3)(C)O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeSenecio erucifolius Ref.
PlantaeAsteraceaeSenecio inaequidens Ref.
PlantaeAsteraceaeSenecio jacobaea Ref.
PlantaeAsteraceaeSenecio vernalis Ref.
PlantaeAsteraceaeSenecio vulgaris Ref.
PlantaeEuphorbiaceaeTyria jacobaeae Ref.
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OrganismSenecio vulgaris
ReferenceT. Hartmann,Planta,206,(1998),443-451