input word = C00004932

Metabolite InformationStructural formula
Name Quercetin 3,3'-dimethyl ether 4'-isovalerate
Formula C22H22O8
Mw 414.13146768
CAS RN 78516-75-3
C_ID C00004932 ,
InChIKey ZQXNTAIEPXSPBP-UHFFFAOYSA-N
InChICode InChI=1S/C22H22O8/c1-11(2)7-18(25)29-15-6-5-12(8-16(15)27-3)21-22(28-4)20(26)19-14(24)9-13(23)10-17(19)30-21/h5-6,8-11,23-24H,7H2,1-4H3
SMILES c1(cc(c2c(c1)oc(c(c2=O)OC)c1ccc(c(c1)OC)OC(=O)CC(C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeGutierrezia dracunculoides Ref.
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