β-Neuraminic acid, N-acetyl-, methyl ester

CAS Registry Number®

22900-11-4

CAS Name

β-Neuraminic acid, N-acetyl-, methyl ester

Molecular Formula

C12H21NO9

Molecular Mass

323.30

Cite this Page

β-Neuraminic acid, N-acetyl-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=22900-11-4 (retrieved 2024-11-21) (CAS RN: 22900-11-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    183 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H21NO9/c1-5(15)13-8-6(16)3-12(20,11(19)21-2)22-10(8)9(18)7(17)4-14/h6-10,14,16-18,20H,3-4H2,1-2H3,(H,13,15)/t6-,7+,8+,9+,10+,12-/m0/s1

InChIKey

InChIKey=BKZQMWNJESHHSA-AGNBLMTLSA-N

SMILES

[C@H]([C@@H](CO)O)(O)[C@]1([C@H](NC(C)=O)[C@@H](O)C[C@](C(OC)=O)(O)O1)[H]

Canonical SMILES

O=C(NC1C(O)CC(O)(OC1C(O)C(O)CO)C(=O)OC)C

Other Names for this Substance

  • β-Neuraminic acid, N-acetyl-, methyl ester
  • D-glycero-D-galacto-Nonulopyranosonic acid, 5-acetamido-3,5-dideoxy-, methyl ester, β-
  • D-glycero-β-D-galacto-2-Nonulopyranosonic acid, 5-(acetylamino)-3,5-dideoxy-, methyl ester
  • Methyl N-acetyl-β-neuraminate
  • N-Acetyl-β-neuraminic acid methyl ester

CAS INSIGHTSTM
Targeted protein degrader structure, illustration