input word = C00004974

Metabolite InformationStructural formula
Name Rhamnazin 3-O-sulfate
Formula C17H14O10S
Mw 410.0307674
CAS RN
C_ID C00004974 ,
InChIKey PQRWDTSPYVEMMM-UHFFFAOYSA-N
InChICode InChI=1S/C17H14O10S/c1-24-9-6-11(19)14-13(7-9)26-16(17(15(14)20)27-28(21,22)23)8-3-4-10(18)12(5-8)25-2/h3-7,18-19H,1-2H3,(H,21,22,23)
SMILES c1(cc(c2c(c1)oc(c(c2=O)OS(=O)(=O)O)c1ccc(c(c1)OC)O)O)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePolygonaceaePolygonum hydropiper Ref.
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