input word = C00005393

Metabolite InformationStructural formula
Name Quercetin 3-apiosyl-(1->2)-galactoside
Formula C26H28O16
Mw 596.13773485
CAS RN 99816-58-7
C_ID C00005393 ,
InChIKey QJWRRPPVKXMSJD-SVIKSCFWNA-N
InChICode InChI=1S/C26H28O16/c27-6-15-17(33)19(35)22(42-25-23(36)26(37,7-28)8-38-25)24(40-15)41-21-18(34)16-13(32)4-10(29)5-14(16)39-20(21)9-1-2-11(30)12(31)3-9/h1-5,15,17,19,22-25,27-33,35-37H,6-8H2/t15-,17+,19+,22-,23-,24+,25+,26-/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@@](CO1)(O)CO)O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygalaceaeSecuridaca diversifolia Ref.
zoom in