input word = C00004136

Metabolite InformationStructural formula
Name 5,7,2'-Trihydroxyflavone 7-glucuronide
Formula C21H18O11
Mw 446.08491142
CAS RN 75853-73-5
C_ID C00004136 ,
InChIKey ZUWLOUKBEQEHEC-GGNWGOABNA-N
InChICode InChI=1S/C21H18O11/c22-10-4-2-1-3-9(10)13-7-12(24)15-11(23)5-8(6-14(15)31-13)30-21-18(27)16(25)17(26)19(32-21)20(28)29/h1-7,16-19,21-23,25-27H,(H,28,29)/t16-,17-,18+,19-,21+/m0/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1ccccc1O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)C(=O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeScutellaria ikonnikovii Ref.
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