input word = C00005382

Metabolite InformationStructural formula
Name Quercimeritrin
Quercetin 7-O-beta-D-glucoside
Quercetin 7-glucoside
Formula C21H20O12
Mw 464.09547611
CAS RN 491-50-9
C_ID C00005382 ,
InChIKey BBFYUPYFXSSMNV-YHAOOQQVNA-N
InChICode InChI=1S/C21H20O12/c22-6-13-15(26)17(28)19(30)21(33-13)31-8-4-11(25)14-12(5-8)32-20(18(29)16(14)27)7-1-2-9(23)10(24)3-7/h1-5,13,15,17,19,21-26,28-30H,6H2/t13-,15-,17+,19-,21-/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O)c1ccc(c(c1)O)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeApiaceaeAstrantia major Ref.
PlantaeApiaceaeOrlaya grandiflora Ref.
PlantaeAsteraceaeClibadium sessile Ref.
PlantaeAsteraceaeGutierrezia grandis Ref.
PlantaeAsteraceaeRhaponticum carthamoides Ref.
PlantaeAsteraceaeTanacetum spp. Ref.
PlantaeDipsacaceaeCephalaria kotschyi Ref.
PlantaeDipsacaceaeCephalaria nachiczevanica Ref.
PlantaeEquisetaceaeEquisetum spp. Ref.
PlantaeEuphorbiaceaeEuphorbia tinctoria Ref.
PlantaeFabaceaeBaptisia lecontei Ref.
PlantaeFabaceaeCaesalpinia pulcherrima Ref.
PlantaeFabaceaeCassia italica Ref.
PlantaeFabaceaeCrotalaria assamica Ref.
PlantaeFabaceaeCrotalaria pallida Ref.
PlantaeFabaceaeKummerowia striata Ref.
PlantaeFabaceaeMacroptilium spp. Ref.
PlantaeFabaceaeVigna spp. Ref.
PlantaeGeraniaceaeErodium spp. Ref.
PlantaeGeraniaceaePelargonium reniforme Ref.
PlantaeLabiataeLeonurus cardiaca Ref.
PlantaeLythraceaePunica granatum Ref.
PlantaeMalvaceaeGossypium hirsutum Ref.
PlantaeMalvaceaeGossypium sp. Ref.
PlantaeMyrtaceaeMyrciaria cauliflora Ref.
PlantaeOrchidaceaeSpiranthes australis (R.BROWN) LINDL. Ref.
PlantaePodocarpaceaePodocarpus fasciculus Ref.
PlantaePodocarpaceaePodocarpus nivalis Ref.
PlantaeSaxifragaceaeLithophragma spp. Ref.
PlantaeSolanaceaeLeucophysalis spp. Ref.
PlantaeSolanaceaePetunia x hybrida Ref.
PlantaeZygophyllaceaeTribulus pentandrus Ref.
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OrganismPodocarpus fasciculus
ReferenceKuo,Chem.Pharm.Bull.,56,(2008),585