input word = C00005484

Metabolite InformationStructural formula
Name Quercetin 3-glucoside-7-glucosyl-(1->4)-rhamnoside
Formula C33H40O21
Mw 772.20620834
CAS RN 142059-75-4
C_ID C00005484 ,
InChIKey LDJDNEHEXIQBED-TXPHPRBXNA-N
InChICode InChI=1S/C33H40O21/c1-9-28(53-32-25(45)22(42)19(39)16(7-34)51-32)24(44)27(47)31(48-9)49-11-5-14(38)18-15(6-11)50-29(10-2-3-12(36)13(37)4-10)30(21(18)41)54-33-26(46)23(43)20(40)17(8-35)52-33/h2-6,9,16-17,19-20,22-28,31-40,42-47H,7-8H2,1H3/t9-,16-,17+,19-,20-,22+,23+,24-,25-,26-,27-,28+,31+,32+,33+/m1/s1
SMILES CC1O[C@@H](Oc2cc(O)c3c(=O)c(O[C@@H]4OC(CO)[C@@H](O)C(O)C4O)c(-c4ccc(O)c(O)c4)oc3c2)C(O)[C@@H](O)[C@H]1O[C@@H]1OC(CO)[C@@H](O)[C@H](O)C1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeLathyrus chrysanthus Ref.
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OrganismLathyrus chrysanthus
ReferenceHarborne, The Handbook of Natural Flavonoids, 1, (1999), 297.Flavonol O-glycosides

Markham,Phytochem.,31,(1992),549