input word = C00058643

Metabolite InformationStructural formula
Name Paeonidanin
Formula C24H30O11
Mw 494.1788118
CAS RN 209969-75-5
C_ID C00058643
InChIKey CUOSPKQOVDKAPD-RIXLYZTQSA-N
InChICode InChI=1S/C24H30O11/c1-22-9-14(26)13-8-24(22,34-20-18(29)17(28)16(27)15(10-25)33-20)23(13,21(31-2)35-22)11-32-19(30)12-6-4-3-5-7-12/h3-7,13,15-18,20-21,25,27-29H,8-11H2,1-2H3/t13-,15+,16+,17-,18+,20-,21-,22-,23-,24-/m0/s1
SMILES CO[C@H]1O[C@@]2(C)CC(=O)[C@@H]3C[C@@]2(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]13COC(=O)c1ccccc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePaeoniaceaePaeonia peregrina Ref.
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