input word = C00005651

Metabolite InformationStructural formula
Name Quercetagetin 7-methyl ether 3-glucoside
Formula C22H22O13
Mw 494.10604079
CAS RN 65180-49-6
C_ID C00005651 ,
InChIKey AGKJZAUTPQSZRO-DEGUQQANNA-N
InChICode InChI=1S/C22H22O13/c1-32-11-5-10-13(16(28)14(11)26)17(29)21(20(33-10)7-2-3-8(24)9(25)4-7)35-22-19(31)18(30)15(27)12(6-23)34-22/h2-5,12,15,18-19,22-28,30-31H,6H2,1H3/t12-,15-,18-,19+,22+/m1/s1
SMILES c1(c(c(c2c(c1)oc(c(c2=O)O[C@H]1[C@H]([C@@H]([C@@H]([C@H](O1)CO)O)O)O)c1ccc(c(c1)O)O)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeParthenium rollinsianum Ref.
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