input word = C00037680

Metabolite InformationStructural formula
Name Premnaionoside
Formula C24H40O12
Mw 520.25197674
CAS RN 272458-28-3
C_ID C00037680 ,
InChIKey YABRKIPLNHWVOR-SLIMPXPFNA-N
InChICode InChI=1S/C24H40O12/c1-12(5-6-24-21(2,3)7-13(27)8-22(24,4)36-24)33-19-17(16(29)15(28)14(9-25)34-19)35-20-18(30)23(31,10-26)11-32-20/h5-6,12-20,25-31H,7-11H2,1-4H3/b6-5+/t12-,13+,14-,15+,16+,17-,18+,19-,20+,22-,23-,24+/m1/s1
SMILES [C@H]1([C@@H]([C@H]([C@@H](O[C@@H]1CO)O[C@@H](/C=C/[C@@]12[C@@](C[C@H](CC1(C)C)O)(O2)C)C)O[C@@H]1OC[C@@]([C@H]1O)(CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAcanthaceaeAcanthus ebracteatus Ref.
zoom in