input word = C00004641

Metabolite InformationStructural formula
Name Quercetin 5,3'-dimethyl ether
3,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-5-methoxy-4H-1-benzopyran-4-one
Formula C17H14O7
Mw 330.0739528
CAS RN 40554-94-7
C_ID C00004641 ,
InChIKey NKJWZTPASPJYBA-UHFFFAOYSA-N
InChICode InChI=1S/C17H14O7/c1-22-11-5-8(3-4-10(11)19)17-16(21)15(20)14-12(23-2)6-9(18)7-13(14)24-17/h3-7,18-19,21H,1-2H3
SMILES COc1cc(-c2oc3cc(O)cc(OC)c3c(=O)c2O)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeHeliotropium stenophyllum Ref.
PlantaeCistaceaeCistus laurifolius Ref.
PlantaeFabaceaeMedicago x varia Ref.
zoom in