input word = C00005141

Metabolite InformationStructural formula
Name Kaempferol 3-glucuronide
Kaempferol-3-O-beta-D-glucuronide
Kaempferol-3-beta-D-glucuronide
Formula C21H18O12
Mw 462.07982604
CAS RN 22688-78-4
C_ID C00005141 ,
InChIKey FNTJVYCFNVUBOL-NTEJZTTHNA-N
InChICode InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)17-18(13(25)12-10(24)5-9(23)6-11(12)31-17)32-21-16(28)14(26)15(27)19(33-21)20(29)30/h1-6,14-16,19,21-24,26-28H,(H,29,30)/t14-,15+,16+,19+,21-/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@H]([C@@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAnethum graveolens Ref.
PlantaeApiaceaeAnethum sowa Ref.
PlantaeApiaceaeFoeniculum vulgare Ref.
PlantaeApiaceaeOrlaya daucorlaya Ref.
PlantaeApiaceaeOrlaya grandiflora Ref.
PlantaeAsteraceaeArnica montana cv.ARBO Ref.
PlantaeAsteraceaeScolymus hispanicus Ref.
PlantaeAsteraceaeStephanodoria tomentella Ref.
PlantaeEbenaceaeDiospyros rhombifolia Ref.
PlantaeEuphorbiaceaeEuphorbia spp. Ref.
PlantaeFabaceaePhaseolus vulgaris Ref.
PlantaeFabaceaeVigna radiata Ref.
PlantaeLabiataePerilla frutescens Ref.
PlantaePhilydraceaePhilydrum lanuginosum Ref.
PlantaePteridaceaeAdiantum capillus-veneris Ref.
PlantaePteridaceaeAdiantum cuneatum Ref.
PlantaeRanunculaceaeAnemone alpina Ref.
PlantaeZingiberaceaeEtlingera elatior Ref.
PlantaeZingiberaceaeRoscoea cauteloides Ref.
PlantaeZingiberaceaeRoscoea humeana Ref.
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