Methyl N-acetyl-alpha-D-glucosaminide

Methyl N-acetyl-alpha-D-glucosaminide bmse000196 - Data bmst000327 - Theory

Methyl_N_acetyl_alpha_D_glucosaminide synonyms

Methyl-2-acetamido-2-deoxy-D-glucopyranoside; Methyl-N-acetylglucosamine; alpha-D-Glucopyranoside, methyl 2-(acetylamino)-2-deoxy-

Wikipedia:

Graphical representations:

methyl_N_acetyl_alpha_D_glucosaminide

View large 3D structure

Molecular Formula: C9H17NO6

Natural Isotopic Abundance Mass: 235.2343800000

Mono-Isotopic Molecular Masses:

  • C12N14: 235.105587284
  • C13N14: 244.135780824
  • C12N15: 236.102622177
  • C13N15: 244.135780824

InChI string: InChI=1/C9H17NO6/c1-4(12)10-6-8(14)7(13)5(3-11)16-9(6)15-2/h5-9,11,13-14H,3H2,1-2H3,(H,10,12)/t5-,6-,7-,8-,9+/m1/s1/f/h10H

IUPAC: N-[(2S,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxy-oxan-3-yl]acetamide

PubChem Compound (CID): 96523
CAS Registry number: 6082-04-8
NSC: 77914

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73, https://www.nature.com/articles/sdata201773)