input word = C00005622

Metabolite InformationStructural formula
Name Dillenetin 5-glucoside-7-glucuronide
Formula C29H32O18
Mw 668.15886422
CAS RN 112368-23-7
C_ID C00005622 ,
InChIKey LRGSZBPJHRDTSP-WHCDFZFPNA-N
InChICode InChI=1S/C29H32O18/c1-41-11-4-3-9(5-12(11)42-2)25-21(35)18(32)16-13(44-25)6-10(43-28-24(38)20(34)22(36)26(47-28)27(39)40)7-14(16)45-29-23(37)19(33)17(31)15(8-30)46-29/h3-7,15,17,19-20,22-24,26,28-31,33-38H,8H2,1-2H3,(H,39,40)/t15-,17-,19+,20+,22+,23-,24-,26+,28-,29-/m1/s1
SMILES COc1ccc(-c2oc3cc(O[C@@H]4OC(C(=O)O)[C@@H](O)[C@H](O)C4O)cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c3c(=O)c2O)cc1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCruciferaeAlyssum minimum Ref.
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OrganismAlyssum minimum
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Afsharypuor,J.Nat.Prod.,49,(1986),944