input word = C00005403

Metabolite InformationStructural formula
Name Quercetin 3-alpha-arabinopyranosyl-(1->2)-glucoside
Formula C26H28O16
Mw 596.13773485
CAS RN 161404-86-0
C_ID C00005403 ,
InChIKey NKFZLEYLWAFYEH-AWSNKWAVNA-N
InChICode InChI=1S/C26H28O16/c27-6-15-18(34)20(36)24(42-25-21(37)17(33)13(32)7-38-25)26(40-15)41-23-19(35)16-12(31)4-9(28)5-14(16)39-22(23)8-1-2-10(29)11(30)3-8/h1-5,13,15,17-18,20-21,24-34,36-37H,6-7H2/t13-,15-,17+,18+,20-,21+,24+,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[C@H]1[C@@H]([C@@H]([C@H](CO1)O)O)O)c1ccc(c(c1)O)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaePhysalis ixocarpa Ref.
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