Name: Name:N-Acetylneuraminic acid methyl ester
Brand: Angene
SKU: AG002LEC
Rating: 90 (10 reviews)

N-Acetylneuraminic acid methyl ester

CAS No.:

22900-11-4

Catalog Number:

AG002LEC

Molecular Formula:

C12H21NO9

Molecular Weight:

323.2964

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

>95.0%(HPLC)

1 week

United States

$566

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Product Description

Catalog Number:

AG002LEC

Chemical Name:

N-Acetylneuraminic acid methyl ester

CAS Number:

22900-11-4

Molecular Formula:

C12H21NO9

Molecular Weight:

323.2964

MDL Number:

MFCD08276447

IUPAC Name:

methyl (2S,4S,5R,6R)-5-acetamido-2,4-dihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylate

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

InChI Key:

BKZQMWNJESHHSA-AGNBLMTLSA-N

SMILES:

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

Properties

Complexity:

417

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

323.122g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

323.298g/mol

Monoisotopic Mass:

323.122g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

166A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-3.1

Literature

Title	Journal
Enzymatic synthesis of sialic acid derivative by immobilized lipase from Candida antarctica.	Bioresource technology 20111101
Molecular Dynamics of Sialic Acid Analogues and their Interaction with Influenza Hemagglutinin.	Indian journal of pharmaceutical sciences 20100101
Determination of sialic acids by liquid chromatography-mass spectrometry.	Journal of chromatography. A 20010413

Properties