Acetaminophen glucuronide
CAS Registry Number®
16110-10-4
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CAS Name
Acetaminophen glucuronideMolecular Formula
C14H17NO8Molecular Mass
327.29Cite this Page
Acetaminophen glucuronide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=16110-10-4 (retrieved ) (CAS RN: 16110-10-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
195-198 °C
Source(s)
Other Names and Identifiers
InChI
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
InChIKey
InChIKey=IPROLSVTVHAQLE-BYNIDDHOSA-N
SMILES
O([C@@H]1O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]1O)C2=CC=C(NC(C)=O)C=C2
Canonical SMILES
O=C(O)C1OC(OC2=CC=C(C=C2)NC(=O)C)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranosiduronic acid, 4-(acetylamino)phenyl
- Glucopyranosiduronic acid, p-acetamidophenyl, β-D-
- β-D-Glucopyranosiduronic acid, p-acetamidophenyl
- β-D-Glucosiduronic acid, p-acetamidophenyl
- 4-(Acetylamino)phenyl β-D-glucopyranosiduronic acid
Deleted or Replaced CAS Registry Numbers
28473-00-9, 30113-43-0, 910899-98-8
