input word = C00006651

Metabolite InformationStructural formula
Name Cyanidin 3-xyloside
Formula C20H19O10
Mw 419.09782183
CAS RN 29761-24-8
C_ID C00006651 ,
InChIKey KUCVMQMKRICXJC-WAOLSSODNA-O
InChICode InChI=1S/C20H18O10/c21-9-4-12(23)10-6-16(30-20-18(27)17(26)14(25)7-28-20)19(29-15(10)5-9)8-1-2-11(22)13(24)3-8/h1-6,14,17-18,20,25-27H,7H2,(H3-,21,22,23,24)/p+1/t14-,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)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeHelianthus annuus Ref.
PlantaeEricaceaeEpacris impressa Ref.
PlantaeRosaceaeAronia melanocarpa Ref.
PlantaeRosaceaeMalus pumila Ref.
PlantaeRosaceaeMalus sylvestris Ref.
PlantaeSaxifragaceaeSaxifraga aizoon Ref.
PlantaeSaxifragaceaeSaxifraga azizoon Ref.
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OrganismSaxifraga azizoon
ReferencePawlowska,Acta Soc.Bot.Pol.,45,(1976),383