input word = C00041435

Metabolite InformationStructural formula
Name Cimicifugic acid D
(+)-Cimicifugic acid D
Formula C20H18O10
Mw 418.0899968
CAS RN 219986-51-3
C_ID C00041435 ,
InChIKey MTGTYFYLZVUKQG-USYIWGANNA-N
InChICode InChI=1S/C20H18O10/c21-13-5-1-12(2-6-13)10-20(29,19(27)28)17(18(25)26)30-16(24)8-4-11-3-7-14(22)15(23)9-11/h1-9,17,21-23,29H,10H2,(H,25,26)(H,27,28)/b8-4+/t17-,20-/m1/s1
SMILES c1(ccc(cc1O)/C=C/C(=O)O[C@@H]([C@@](Cc1ccc(cc1)O)(O)C(=O)O)C(=O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeActaea racemosa Ref.
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