input word = C00058273

Metabolite InformationStructural formula
Name 6''-Sulfoglucoluteolin
Formula C21H20O14S
Mw 528.05737608
CAS RN 935262-10-5
C_ID C00058273
InChIKey IXCYSCKVWYPZJS-QNDFHXLGSA-N
InChICode InChI=1S/C21H20O14S/c22-10-2-1-8(3-11(10)23)14-6-13(25)17-12(24)4-9(5-15(17)34-14)33-21-20(28)19(27)18(26)16(35-21)7-32-36(29,30)31/h1-6,16,18-24,26-28H,7H2,(H,29,30,31)/t16-,18-,19+,20-,21-/m1/s1
SMILES O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O[C@@H]3O[C@H](COS(=O)(=O)O)[C@@H](O)[C@H](O)[C@H]3O)cc(O)c12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeSalvia fruticosa Ref.
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