input word = C00006654

Metabolite InformationStructural formula
Name Cyanidin 4'-glucoside
Formula C21H21O11
Mw 449.10838652
CAS RN 802884-14-6
C_ID C00006654 ,
InChIKey CSNMEDJMOXSNRZ-DNLILFCWNA-O
InChICode InChI=1S/C21H20O11/c22-7-16-17(27)18(28)19(29)21(32-16)31-14-2-1-8(3-12(14)25)20-13(26)6-10-11(24)4-9(23)5-15(10)30-20/h1-6,16-19,21-22,27-29H,7H2,(H3-,23,24,25,26)/p+1/t16-,17-,18-,19+,21-/m1/s1
SMILES c1(cc(c2c(c1)[o+]c(c(c2)O)c1ccc(c(c1)O)O[C@H]1[C@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAlliaceaeAllium cepa Ref.
PlantaeMalvaceaeAbelmoschus esculentus Ref.
PlantaeMalvaceaeHibiscus esculentus Ref.
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