input word = C00052175

Metabolite InformationStructural formula
Name Acetaminophen sulfate
Formula C8H9NO5S
Mw 231.02014314
CAS RN 10066-90-7
C_ID C00052175
InChIKey IGTYILLPRJOVFY-UHFFFAOYSA-N
InChICode InChI=1S/C8H9NO5S/c1-6(10)9-7-2-4-8(5-3-7)14-15(11,12)13/h2-5H,1H3,(H,9,10)(H,11,12,13)
SMILES CC(=O)Nc1ccc(OS(=O)(=O)O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
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