input word = C00046740

Metabolite InformationStructural formula
Name Faleoconitine
Formula C35H47NO13
Mw 689.3047406
CAS RN 307495-69-8
C_ID C00046740 ,
InChIKey RIFDYFATSFADDY-UHFFFAOYNA-N
InChICode InChI=1S/C35H47NO13/c1-17(38)49-34-13-24(46-6)33(41)12-19(25(34)30(33)48-31(40)18-8-9-20(43-3)21(10-18)44-4)35-23(45-5)11-22(39)32(15-42-2)14-36(16-37)29(35)26(34)27(47-7)28(32)35/h8-10,16,19,22-30,39,41H,11-15H2,1-7H3/t19-,22+,23-,24+,25-,26-,27-,28+,29+,30+,32-,33+,34-,35-/m0/s1
SMILES C1[C@H]([C@@]2([C@@H]3[C@@]4([C@H]1OC)[C@@H]1[C@@H]5[C@@](C[C@H]([C@]([C@@H]5OC(=O)c5ccc(c(c5)OC)OC)(O)C1)OC)([C@@H]([C@@H]3OC)[C@H]4N(C2)C=O)OC(=O)C)COC)O
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Tyr Secologanin
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum falconeri Ref.
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