input word = C00004452

Metabolite InformationStructural formula
Name Tricetin 3'-xyloside
Formula C20H18O11
Mw 434.08491142
CAS RN 117247-36-6
C_ID C00004452 ,
InChIKey MOJNAYLABXOGSJ-HGGLOQBPNA-N
InChICode InChI=1S/C20H18O11/c21-8-3-9(22)16-10(23)5-13(30-14(16)4-8)7-1-11(24)17(26)15(2-7)31-20-19(28)18(27)12(25)6-29-20/h1-5,12,18-22,24-28H,6H2/t12-,18+,19-,20+/m1/s1
SMILES c1(cc(c2c(c1)oc(cc2=O)c1cc(c(c(c1)O)O)O[C@H]1[C@@H]([C@H]([C@@H](CO1)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeUlmaceaeTrema humbertii Ref.
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