input word = C00005340

Metabolite InformationStructural formula
Name Rhodalin
Formula C20H18O11
Mw 434.08491142
CAS RN 54676-60-7
C_ID C00005340 ,
InChIKey HSBPTANNLNRKFF-CIBIJUCENA-N
InChICode InChI=1S/C20H18O11/c21-8-3-1-7(2-4-8)17-15(27)14(26)12-9(22)5-10(23)18(19(12)30-17)31-20-16(28)13(25)11(24)6-29-20/h1-5,11,13,16,20-25,27-28H,6H2/t11-,13+,16+,20-/m1/s1
SMILES c1(cc(c2c(c1O[C@@H]1[C@H]([C@H]([C@@H](CO1)O)O)O)oc(c(c2=O)O)c1ccc(cc1)O)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCrassulaceaeSedum takesimense Nakai Ref.
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