input word = C00010167

Metabolite InformationStructural formula
Name Prunetin 5-O-glucoside
Prunetinoside
Formula C22H22O10
Mw 446.12129692
CAS RN 89595-66-4
C_ID C00010167 ,
InChIKey AJAGLPDYKVWJQE-RSBVYOOMNA-N
InChICode InChI=1S/C22H22O10/c1-29-12-6-14-17(18(25)13(9-30-14)10-2-4-11(24)5-3-10)15(7-12)31-22-21(28)20(27)19(26)16(8-23)32-22/h2-7,9,16,19-24,26-28H,8H2,1H3/t16-,19+,20-,21+,22+/m0/s1
SMILES c1(cc2c(c(=O)c(co2)c2ccc(cc2)O)c(c1)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaePrunus cerasus Ref.
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