input word = C00005494

Metabolite InformationStructural formula
Name Quercetin 3-methyl ether 3'-xyloside
Formula C21H20O11
Mw 448.10056148
CAS RN 93373-16-1
C_ID C00005494 ,
InChIKey ASKKBGQVSVTIAW-TZWZPSPLNA-N
InChICode InChI=1S/C21H20O11/c1-29-20-17(27)15-11(24)5-9(22)6-14(15)31-19(20)8-2-3-10(23)13(4-8)32-21-18(28)16(26)12(25)7-30-21/h2-6,12,16,18,21-26,28H,7H2,1H3/t12-,16+,18+,21+/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)OC)c1ccc(c(c1)O[C@@H]1[C@@H]([C@@H]([C@H](CO1)O)O)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEricaceaeLedum palustre Ref.
PlantaeNymphaeaceaeNymphaea alba Ref.
PlantaePodocarpaceaeDacrycarpus dacrydioides Ref.
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