input word = C00046343

Metabolite InformationStructural formula
Name Quinquangulin 6-O-beta-D-glucopyranoside
(-)-Quinquangulin 6-O-beta-D-glucopyranoside
Formula C22H24O10
Mw 448.13694699
CAS RN 132922-82-8
C_ID C00046343 ,
InChIKey LMHFPNXXSGHPCH-CLVFLOMQNA-N
InChICode InChI=1S/C22H24O10/c1-8-4-11(24)17-13(30-8)5-10-9(2)12(29-3)6-14(16(10)19(17)26)31-22-21(28)20(27)18(25)15(7-23)32-22/h4-6,15,18,20-23,25-28H,7H2,1-3H3/t15-,18-,20+,21-,22-/m1/s1
SMILES c1c(oc2c(c1=O)c(c1c(c2)c(c(cc1O[C@@H]1O[C@@H]([C@H]([C@@H]([C@H]1O)O)O)CO)OC)C)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCassia quinquangulata Ref.
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