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Structure

3-Fluoro-N-acetylneuraminic acid

CAS
921-40-4
Catalog Number
ACM921404
Category
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What is the molecular formula of 3-Fluoro-N-acetylneuraminic acid?

The molecular formula of 3-Fluoro-N-acetylneuraminic acid is C11H18FNO9.

When was 3-Fluoro-N-acetylneuraminic acid created and modified on PubChem?

3-Fluoro-N-acetylneuraminic acid was created on August 8, 2005, and last modified on December 30, 2023.

What is the IUPAC name of 3-Fluoro-N-acetylneuraminic acid?

The IUPAC name of 3-Fluoro-N-acetylneuraminic acid is (2R,4R,5R,6R)-5-acetamido-3-fluoro-2,4-dihydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid.

What is the Canonical SMILES representation of 3-Fluoro-N-acetylneuraminic acid?

The Canonical SMILES representation of 3-Fluoro-N-acetylneuraminic acid is CC(=O)NC1C(C(C(OC1C(C(CO)O)O)(C(=O)O)O)F)O.

What is the InChIKey of 3-Fluoro-N-acetylneuraminic acid?

The InChIKey of 3-Fluoro-N-acetylneuraminic acid is ALJLGESFXXDPKH-GPBUIYQJSA-N.

How many hydrogen bond donor counts does 3-Fluoro-N-acetylneuraminic acid have?

3-Fluoro-N-acetylneuraminic acid has 7 hydrogen bond donor counts.

What is the topological polar surface area of 3-Fluoro-N-acetylneuraminic acid?

The topological polar surface area of 3-Fluoro-N-acetylneuraminic acid is 177 Ų.

How many defined atom stereocenters does 3-Fluoro-N-acetylneuraminic acid have?

3-Fluoro-N-acetylneuraminic acid has 6 defined atom stereocenters.

What is the exact mass of 3-Fluoro-N-acetylneuraminic acid?

The exact mass of 3-Fluoro-N-acetylneuraminic acid is 327.09655931 g/mol.

How many heavy atoms are present in the structure of 3-Fluoro-N-acetylneuraminic acid?

There are 22 heavy atoms in the structure of 3-Fluoro-N-acetylneuraminic acid.

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