input word = C00004339

Metabolite InformationStructural formula
Name 5,7,4'-Trihydroxy-3'-methoxyflavone
Luteolin 3'-methyl ether 7-glucuronide
Chrysoeriol 7-O-glucuronide
Formula C22H20O12
Mw 476.09547611
CAS RN 29741-07-9
C_ID C00004339 ,
InChIKey VLYLVFHVHHGXHX-ACYPGOOPNA-N
InChICode InChI=1S/C22H20O12/c1-31-14-4-8(2-3-10(14)23)13-7-12(25)16-11(24)5-9(6-15(16)33-13)32-22-19(28)17(26)18(27)20(34-22)21(29)30/h2-7,17-20,22-24,26-28H,1H3,(H,29,30)/t17-,18-,19+,20-,22+/m0/s1
SMILES COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4OC(C(=O)O)[C@@H](O)[C@H](O)C4O)cc3o2)ccc1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeDaucus carota Ref.
PlantaeAsteraceaeArtemisia judaica Ref.
PlantaeFabaceaeMedicago arabica Ref.
PlantaeFabaceaeMedicago polymorpha Ref.
PlantaeFabaceaeMedicago sativa Ref.
PlantaeOrobanchaceaePedicularis longiflora var. tubiformis Ref.
PlantaePlantaginaceaeAntirrhinum majus Ref.
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