Chloramphenicol 3-glucuronide

CAS Registry Number®

39751-33-2
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CAS Name

Chloramphenicol 3-glucuronide

Molecular Formula

C17H20Cl2N2O11

Molecular Mass

499.25

Cite this Page

Chloramphenicol 3-glucuronide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=39751-33-2 (retrieved 2024-04-25) (CAS RN: 39751-33-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H20Cl2N2O11/c18-14(19)15(26)20-8(9(22)6-1-3-7(4-2-6)21(29)30)5-31-17-12(25)10(23)11(24)13(32-17)16(27)28/h1-4,8-14,17,22-25H,5H2,(H,20,26)(H,27,28)/t8-,9-,10+,11+,12-,13+,17-/m1/s1

InChIKey

InChIKey=UARPTSDFEIFMJP-PEXHWNMISA-N

SMILES

O(C[C@H]([C@H](O)C1=CC=C(N(=O)=O)C=C1)NC(C(Cl)Cl)=O)[C@@H]2O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]2O

Canonical SMILES

O=C(O)C1OC(OCC(NC(=O)C(Cl)Cl)C(O)C2=CC=C(C=C2)N(=O)=O)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranosiduronic acid, (2R,3R)-2-[(2,2-dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl
  • β-D-Glucopyranosiduronic acid, 2-[(dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl, [R-(R*,R*)]-
  • Glucopyranosiduronic acid, 2-(2,2-dichloroacetamido)-3-hydroxy-3-(p-nitrophenyl)propyl, β-D-
  • β-D-Glucopyranosiduronic acid, (2R,3R)-2-[(dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl
  • (2R,3R)-2-[(2,2-Dichloroacetyl)amino]-3-hydroxy-3-(4-nitrophenyl)propyl β-D-glucopyranosiduronic acid

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Deleted or Replaced CAS Registry Numbers

70858-74-1

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