input word = C00005432

Metabolite InformationStructural formula
Name Quercetin 3,7-di-O-alpha-L-rhamnopyranoside
Quercetin 3,7-dirhamnoside
Formula C27H30O15
Mw 594.15847029
CAS RN 28638-13-3
C_ID C00005432 ,
InChIKey GXLQUHPXGLZNGE-BTLHDPFCNA-N
InChICode InChI=1S/C27H30O15/c1-8-17(31)20(34)22(36)26(38-8)40-11-6-14(30)16-15(7-11)41-24(10-3-4-12(28)13(29)5-10)25(19(16)33)42-27-23(37)21(35)18(32)9(2)39-27/h3-9,17-18,20-23,26-32,34-37H,1-2H3/t8-,9-,17-,18-,20-,21+,22+,23-,26-,27-/m0/s1
SMILES c1(cc(c2c(c1)oc(c(c2=O)O[C@@H]1O[C@H]([C@@H]([C@H]([C@@H]1O)O)O)C)c1ccc(c(c1)O)O)O)O[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)C)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeClibadium pilonicum Ref.
PlantaeAsteraceaeClibadium surinamense Ref.
PlantaeCelastraceaeCelastrus orbiculatus Ref.
PlantaeCrassulaceaeSedum sarmentosum Ref.
PlantaeCrassulaceaeSedum telephium Ref.
PlantaeCruciferaeArabidopsis thaliana Ref.
PlantaeErythroxylaceaeErythroxylum vacciniifolium Ref.
PlantaeFabaceaeLotus corniculatus Ref.
PlantaeRosaceaeMespilus germanica Ref.
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