input word = C00013838

Metabolite InformationStructural formula
Name Quercetin 3-alpha-L-arabinofuranosyl-(1->2)-glucoside
Formula C26H28O16
Mw 596.13773485
CAS RN
C_ID C00013838 ,
InChIKey GPNPEZQRRZCPJF-NCVXCLOONA-N
InChICode InChI=1S/C26H28O16/c27-6-14-17(33)20(36)24(42-25-21(37)18(34)15(7-28)39-25)26(40-14)41-23-19(35)16-12(32)4-9(29)5-13(16)38-22(23)8-1-2-10(30)11(31)3-8/h1-5,14-15,17-18,20-21,24-34,36-37H,6-7H2/t14-,15-,17-,18-,20+,21+,24-,25-,26+/m1/s1
SMILES c1c(cc(c(c1)O)O)c1oc2c(c(=O)c1O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O[C@@H]1[C@H]([C@H](O)[C@H](O1)CO)O)c(cc(c2)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRosaceaePrunus spinosa Ref.
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