input word = C00005779

Metabolite InformationStructural formula
Name Syringetin 3-glucuronide
Formula C23H22O14
Mw 522.10095541
CAS RN
C_ID C00005779 ,
InChIKey DIWWVZPWHQBEMJ-NMYXUETCNA-N
InChICode InChI=1S/C23H22O14/c1-33-11-3-7(4-12(34-2)14(11)26)19-20(15(27)13-9(25)5-8(24)6-10(13)35-19)36-23-18(30)16(28)17(29)21(37-23)22(31)32/h3-6,16-18,21,23-26,28-30H,1-2H3,(H,31,32)/t16-,17+,18+,21+,23-/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@H]([C@@H]([C@@H]([C@H](O1)C(=O)O)O)O)O)c1cc(c(c(c1)OC)O)OC)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePhilydraceaePhilydrum lanuginosum Ref.
PlantaeVitaceaeVitis vinifera cv. Petit Verdot Ref.
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