input word = C00035206

Metabolite InformationStructural formula
Name 14-O-Acetylsachaconitine
Formula C25H39NO5
Mw 433.28282336
CAS RN 102719-98-2
C_ID C00035206 ,
InChIKey VYNDUGHWSKLKFB-UHFFFAOYNA-N
InChICode InChI=1S/C25H39NO5/c1-6-26-12-23(3)8-7-19(30-5)25-15-9-14-17(29-4)11-24(28,16(22(25)26)10-18(23)25)20(15)21(14)31-13(2)27/h14-22,28H,6-12H2,1-5H3/t14-,15-,16+,17+,18-,19-,20-,21-,22-,23+,24+,25-/m0/s1
SMILES [C@H]12[C@@H]3N(C[C@@]4([C@@H]([C@@]3([C@H]3C[C@H]5[C@@H](C[C@@]2([C@@H]3[C@H]5OC(=O)C)O)OC)[C@H](CC4)OC)C1)C)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum deiphinifolium Ref.
PlantaeRanunculaceaeAconitum variegatum L. Ref.
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