input word = C00041437

Metabolite InformationStructural formula
Name Cimicifugic acid F
(+)-Cimicifugic acid F
Formula C21H20O10
Mw 432.10564686
CAS RN 220618-91-7
C_ID C00041437 ,
InChIKey WBGMKAAMRFEBHK-YLDCYAMMNA-N
InChICode InChI=1S/C21H20O10/c1-30-16-8-4-12(10-15(16)23)5-9-17(24)31-18(19(25)26)21(29,20(27)28)11-13-2-6-14(22)7-3-13/h2-10,18,22-23,29H,11H2,1H3,(H,25,26)(H,27,28)/b9-5+/t18-,21-/m1/s1
SMILES c1(ccc(cc1O)/C=C/C(=O)O[C@@H]([C@@](Cc1ccc(cc1)O)(O)C(=O)O)C(=O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeActaea racemosa Ref.
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