2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl β-D-glucopyranosiduronic acid

CAS Registry Number®

100495-98-5
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CAS Name

2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl β-D-glucopyranosiduronic acid

Molecular Formula

C12H17N3O9

Molecular Mass

347.28

Cite this Page

2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl β-D-glucopyranosiduronic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=100495-98-5 (retrieved 2024-06-26) (CAS RN: 100495-98-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H17N3O9/c1-5-13-4-6(15(21)22)14(5)2-3-23-12-9(18)7(16)8(17)10(24-12)11(19)20/h4,7-10,12,16-18H,2-3H2,1H3,(H,19,20)/t7-,8-,9+,10-,12+/m0/s1

InChIKey

InChIKey=KOVNZSSTXZPVCG-GOVZDWNOSA-N

SMILES

C(CO[C@@H]1O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]1O)N2C(N(=O)=O)=CN=C2C

Canonical SMILES

O=C(O)C1OC(OCCN2C(=NC=C2N(=O)=O)C)C(O)C(O)C1O

Other Names for this Substance

  • β-D-Glucopyranosiduronic acid, 2-(2-methyl-5-nitro-1H-imidazol-1-yl)ethyl
  • 2-(2-Methyl-5-nitro-1H-imidazol-1-yl)ethyl β-D-glucopyranosiduronic acid
  • Metronidazole glucuronide