input word = C00052174

Metabolite InformationStructural formula
Name Acetaminophen glucuronide
Formula C14H17NO8
Mw 327.09541653
CAS RN 16110-10-4
C_ID C00052174
InChIKey IPROLSVTVHAQLE-BYNIDDHOSA-N
InChICode InChI=1S/C14H17NO8/c1-6(16)15-7-2-4-8(5-3-7)22-14-11(19)9(17)10(18)12(23-14)13(20)21/h2-5,9-12,14,17-19H,1H3,(H,15,16)(H,20,21)/t9-,10-,11+,12-,14+/m0/s1
SMILES CC(=O)Nc1ccc(O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)cc1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHominidaeHomo sapiens (Urine) Ref.
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