input word = C00006790

Metabolite InformationStructural formula
Name Pelargonidin 5-galactoside
Formula C21H21O10
Mw 433.11347189
CAS RN 157526-28-8
C_ID C00006790 ,
InChIKey AFRWRFLTMADQHJ-YPMRAXCCNA-O
InChICode InChI=1S/C21H20O10/c22-8-16-17(26)18(27)19(28)21(31-16)30-15-6-11(24)5-14-12(15)7-13(25)20(29-14)9-1-3-10(23)4-2-9/h1-7,16-19,21-22,26-28H,8H2,(H2-,23,24,25)/p+1/t16-,17+,18+,19-,21-/m1/s1
SMILES c1(cc(c2c(c1)[o+]c(c(c2)O)c1ccc(cc1)O)O[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCassia auriculata Ref.
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