input word = C00024816

Metabolite InformationStructural formula
Name 15-Benzoylpseudokobusine
Pseudokobusine 15-benzoate
Formula C27H31NO4
Mw 433.22530849
CAS RN 112574-95-5
C_ID C00024816 ,
InChIKey WWVFYKBASWLHCJ-DIPKCMACNA-N
InChICode InChI=1S/C27H31NO4/c1-14-16-11-17-20-25-10-6-9-24(2)13-28(20)27(31,23(24)25)12-26(17,19(25)18(16)29)21(14)32-22(30)15-7-4-3-5-8-15/h3-5,7-8,16-21,23,29,31H,1,6,9-13H2,2H3/t16-,17-,18+,19+,20-,21-,23-,24-,25+,26-,27-/m1/s1
SMILES C1[C@]2(CCC[C@]34[C@@H]2[C@@]2(C[C@@]56[C@H]3[C@H]([C@@H](C(=C)[C@H]5OC(=O)c3ccccc3)C[C@@H]6[C@H]4N12)O)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro L-Asp IPP
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeAconitum yesoense var.macroyesoense Ref.
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OrganismAconitum yesoense var.macroyesoense
ReferenceBando,Heterocycles,26,(1987),2623

Wada,J.Pharm.Sci.,76,(1987),216