input word = C00005229

Metabolite InformationStructural formula
Name Kaempferol 3-O-sophoroside 7-O-beta-D-glucopyranoside:Kaempferol 3-sophoroside-7-glucoside
(-)-Kaempferol 3-O-sophoroside 7-O-beta-D-glucopyranoside
Formula C33H40O21
Mw 772.20620834
CAS RN 55136-76-0
C_ID C00005229 ,
InChIKey MBFNAZBJKVFNKZ-YIRMBCKDNA-N
InChICode InChI=1S/C33H40O21/c34-7-15-19(39)23(43)26(46)31(50-15)48-12-5-13(38)18-14(6-12)49-28(10-1-3-11(37)4-2-10)29(22(18)42)53-33-30(25(45)21(41)17(9-36)52-33)54-32-27(47)24(44)20(40)16(8-35)51-32/h1-6,15-17,19-21,23-27,30-41,43-47H,7-9H2/t15-,16+,17+,19-,20-,21-,23+,24+,25+,26-,27-,30-,31-,32+,33+/m1/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O[C@H]1[C@@H]([C@H]([C@@H]([C@@H](O1)CO)O)O)O)c1ccc(cc1)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
PlantaeAmaryllidaceaeGalanthus nivalis Ref.
PlantaeCruciferaeBrassica napus Ref.
PlantaeCruciferaeBrassica oleracea Ref.
PlantaeCruciferaeBrassica rapa Ref.
PlantaeCruciferaeSinapis arvensis Ref.
PlantaeElaeagnaceaeElaeagnus multiflora Ref.
PlantaeEquisetaceaeEquisetum debile Ref.
PlantaeEquisetaceaeEquisetum spp. Ref.
PlantaeFabaceaeLathyrus vernus Ref.
PlantaeHostaceaeHosta ventricosa Ref.
PlantaeRosaceaePotentilla spp. Ref.
PlantaeSolanaceaeNicotiana spp. Ref.
PlantaeSolanaceaePetunia x hybrida Ref.
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OrganismEquisetum spp.
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Harborne,Phytochem.,4,(1965),107

Griesbach,Plant Sci.,70,(1990),49