input word = C00006696

Metabolite InformationStructural formula
Name Delphinidin 3-arabinoside
Formula C20H19O11
Mw 435.09273645
CAS RN 28500-01-8
C_ID C00006696 ,
InChIKey XZUBZVMZVWFBNE-CRJFCAEUNA-O
InChICode InChI=1S/C20H18O11/c21-8-3-10(22)9-5-15(31-20-18(28)17(27)13(25)6-29-20)19(30-14(9)4-8)7-1-11(23)16(26)12(24)2-7/h1-5,13,17-18,20,25,27-28H,6H2,(H4-,21,22,23,24,26)/p+1/t13-,17+,18-,20-/m0/s1
SMILES c1(cc(c2c(c1)[o+]c(c(c2)O[C@H]1[C@H]([C@@H]([C@H](CO1)O)O)O)c1cc(c(c(c1)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCarthamus glauca Ref.
PlantaeEricaceaeAcrotriche serrulata Ref.
PlantaeEricaceaeEmpetrum nigrum Ref.
PlantaeEricaceaeEpacris gunnii Ref.
PlantaeEricaceaeLeucopogon collinus Ref.
PlantaeEricaceaePentachondra ericaefolia Ref.
PlantaeEricaceaeRhododendron spp. Ref.
PlantaeEricaceaeTrochocarpa spp. Ref.
PlantaeEricaceaeVaccinium angustifolium Ref.
PlantaeEricaceaeVaccinium arboreum Ref.
PlantaeEricaceaeVaccinium padifolium Ref.
PlantaeEricaceaeVaccinium spp. Ref.
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OrganismVaccinium spp.
ReferencePratt,D.D.etal.,JCS,127,(1925),166