input word = C00029140

Metabolite InformationStructural formula
Name Tongoline
Formula C25H39NO6
Mw 449.27773799
CAS RN 123064-67-5
C_ID C00029140 ,
InChIKey YJGCDYZVPDJIII-UHFFFAOYNA-N
InChICode InChI=1S/C25H39NO6/c1-6-26-11-22(2)8-7-16(29-4)24-14-9-13-15(28-3)10-23(17(14)18(13)27)25(21(24)26,32-12-31-23)20(30-5)19(22)24/h13-21,27H,6-12H2,1-5H3/t13-,14-,15-,16-,17-,18-,19-,20+,21+,22+,23-,24+,25-/m1/s1
SMILES C(N1[C@@H]2[C@]34[C@H]([C@H]5[C@]2([C@@H]2C[C@@H]6[C@@H](C[C@]3([C@H]2[C@@H]6O)OCO4)OC)[C@@H](CC[C@]5(C1)C)OC)OC)C
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Arg Cholesterol
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeDelphinium tongolense Franch. Ref.
zoom in