Sulfamethoxazole N1-glucuronide
CAS Registry Number®
14365-52-7
CAS Name
Sulfamethoxazole N1-glucuronideMolecular Formula
C16H19N3O9SMolecular Mass
429.40Cite this Page
Sulfamethoxazole N1-glucuronide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=14365-52-7 (retrieved ) (CAS RN: 14365-52-7). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C16H19N3O9S/c1-7-6-10(18-28-7)19(29(25,26)9-4-2-8(17)3-5-9)15-13(22)11(20)12(21)14(27-15)16(23)24/h2-6,11-15,20-22H,17H2,1H3,(H,23,24)/t11-,12-,13+,14-,15+/m0/s1
InChIKey
InChIKey=BLFOMTRQSZIMKK-SBJFKYEJSA-N
SMILES
N(S(=O)(=O)C1=CC=C(N)C=C1)([C@@H]2O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]2O)C=3C=C(C)ON3
Canonical SMILES
O=C(O)C1OC(N(C2=NOC(=C2)C)S(=O)(=O)C3=CC=C(N)C=C3)C(O)C(O)C1O
Other Names for this Substance
- β-D-Glucopyranuronic acid, 1-[[(4-aminophenyl)sulfonyl](5-methyl-3-isoxazolyl)amino]-1-deoxy-
- 1-[[(4-Aminophenyl)sulfonyl](5-methyl-3-isoxazolyl)amino]-1-deoxy-β-D-glucopyranuronic acid
- Sulfisomezole N1-glucuronide
- Sulfamethoxazole N1-glucuronide
Deleted or Replaced CAS Registry Numbers
35174-94-8, 81048-41-1