input word = C00006679

Metabolite InformationStructural formula
Name Peonidin 3-arabinoside
Peonidin-3-arabinoside
Formula C21H21O10
Mw 433.11347189
CAS RN 27214-74-0
C_ID C00006679 ,
InChIKey KRUPPTWQKIEURV-BLIGOVTRNA-O
InChICode InChI=1S/C21H20O10/c1-28-16-4-9(2-3-12(16)23)20-17(31-21-19(27)18(26)14(25)8-29-21)7-11-13(24)5-10(22)6-15(11)30-20/h2-7,14,18-19,21,25-27H,8H2,1H3,(H2-,22,23,24)/p+1/t14-,18+,19-,21+/m1/s1
SMILES c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O)c1ccc(c(c1)OC)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlliaceaeAllium cepa Ref.
PlantaeAnacardiaceaeMangifera indica Ref.
PlantaeEricaceaeEmpetrum nigrum Ref.
PlantaeEricaceaeGaylussacia spp. Ref.
PlantaeEricaceaeVaccinium corymbosum Ref.
PlantaeEricaceaeVaccinium macrocarpon Ref.
PlantaeEricaceaeVaccinium padifolium Ref.
PlantaePoaceaeOryza sativa Ref.
PlantaePoaceaePhalaris arundinacea Ref.
PlantaeRosaceaePrunus laurocerasus Ref.
zoom in