input word = C00005423

Metabolite InformationStructural formula
Name Quercetin 3-galactoside-7-xyloside
Formula C26H28O16
Mw 596.13773485
CAS RN
C_ID C00005423 ,
InChIKey PSTSYYSBVQVSOG-PBMYRVLRNA-N
InChICode InChI=1S/C26H28O16/c27-6-15-18(33)20(35)22(37)26(41-15)42-24-19(34)16-12(30)4-9(39-25-21(36)17(32)13(31)7-38-25)5-14(16)40-23(24)8-1-2-10(28)11(29)3-8/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2/t13-,15-,17-,18-,20-,21-,22+,25-,26-/m0/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)c1ccc(c(c1)O)O)O)O[C@H]1[C@H]([C@H]([C@H](CO1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeRanunculaceaeCaltha palustris Ref.
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