input word = C00013737

Metabolite InformationStructural formula
Name Kaempferol 5-glucuronide
3,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-5-yl beta-D-glucopyranosiduronic acid
Formula C21H18O12
Mw 462.07982604
CAS RN 367522-86-9
C_ID C00013737 ,
InChIKey AESGYRCGOWUBNU-UQOQZCQMNA-N
InChICode InChI=1S/C21H18O12/c22-8-3-1-7(2-4-8)18-15(26)13(24)12-10(31-18)5-9(23)6-11(12)32-21-17(28)14(25)16(27)19(33-21)20(29)30/h1-6,14,16-17,19,21-23,25-28H,(H,29,30)/t14-,16-,17+,19-,21+/m0/s1
SMILES O=C(O)C1O[C@@H](Oc2cc(O)cc3oc(-c4ccc(O)cc4)c(O)c(=O)c23)C(O)[C@@H](O)[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeLeucanthemum vulgare Ref.
zoom in