input word = C00004443

Metabolite InformationStructural formula
Name Tricin 7-xyloside
Formula C22H22O11
Mw 462.11621155
CAS RN
C_ID C00004443 ,
InChIKey MJMGQZTXKNKYCG-YGYFYCMYNA-N
InChICode InChI=1S/C22H22O11/c1-29-16-3-9(4-17(30-2)20(16)27)14-7-12(24)18-11(23)5-10(6-15(18)33-14)32-22-21(28)19(26)13(25)8-31-22/h3-7,13,19,21-23,25-28H,8H2,1-2H3/t13-,19+,21-,22+/m0/s1
SMILES COc1cc(-c2cc(=O)c3c(O)cc(O[C@@H]4OC[C@@H](O)[C@H](O)C4O)cc3o2)cc(OC)c1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCyperaceaeCarex nigromarginata Ref.
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