input word = C00043476

Metabolite InformationStructural formula
Name Echitamidine N-oxide
Formula C20H24N2O4
Mw 356.17360727
CAS RN 162870-39-5
C_ID C00043476 ,
InChIKey WSBPZWLQDOELJZ-DJYNTFIONA-N
InChICode InChI=1S/C20H24N2O4/c1-11(23)13-10-22(25)8-7-20-14-5-3-4-6-15(14)21-18(20)17(19(24)26-2)12(13)9-16(20)22/h3-6,11-13,16,21,23H,7-10H2,1-2H3/t11-,12?,13-,16-,20+,22-/m0/s1
SMILES COC(=O)C1=C2Nc3ccccc3[C@@]23CC[N+]2([O-])C[C@@H]([C@H](C)O)[C@@H]1C[C@@H]32
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Secologanin
Organism
Kingdom Family Species Reference
PlantaeApocynaceaeAlstonia scholaris Ref.
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