input word = C00028136

Metabolite InformationStructural formula
Name Dehydroacosanine
(+)-Dehydroacosanine
Formula C25H39NO7
Mw 465.27265261
CAS RN 192386-07-5
C_ID C00028136 ,
InChIKey AYTFWBKYUIWMFQ-UHFFFAOYNA-N
InChICode InChI=1S/C25H39NO7/c1-6-26-11-22(12-30-2)8-7-16(32-4)24-14-9-13-15(31-3)10-23(28,17(14)18(13)33-5)25(29,21(24)26)20(27)19(22)24/h13-19,21,28-29H,6-12H2,1-5H3/t13-,14-,15+,16-,17-,18-,19+,21-,22-,23-,24-,25+/m1/s1
SMILES N1(C[C@@]2([C@H]3[C@]4([C@@H]1[C@@](C3=O)([C@@]1([C@@H]3[C@H]4C[C@H]([C@H](C1)OC)[C@H]3OC)O)O)[C@@H](CC2)OC)COC)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Arg Secologanin
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum leucostomum Worosch. Ref.
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OrganismAconitum leucostomum Worosch.
ReferenceXiao-yi,Acta Bot.Sin.,38,(1996),995