input word = C00025028

Metabolite InformationStructural formula
Name Vakhmadine
Formula C21H30NO4
Mw 360.21748345
CAS RN 135250-80-5
C_ID C00025028 ,
InChIKey PXDVROMVDLBVNK-COSCEJNUNA-N
InChICode InChI=1S/C21H30NO4/c1-9-5-19-7-21(26)17-18(2)8-22(21,3)15-13(19)14(24)10(9)4-12(19)20(15,17)6-11(23)16(18)25/h10-17,23-26H,1,4-8H2,2-3H3/q+1/t10-,11+,12+,13+,14-,15+,16+,17+,18+,19+,20-,21+,22-/m0/s1
SMILES C1[N@+]2([C@@H]3[C@H]4[C@H]([C@@H]5C(=C)C[C@@]64C[C@]2([C@@H]2[C@]1([C@@H]([C@H](O)C[C@]32[C@@H]6C5)O)C)O)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Arg
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum palmatum Ref.
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OrganismAconitum palmatum
ReferenceJiang,J.Nat.Prod.,54,(1991),525