CAS 7512-17-6|N acetylglucosamine|N-((2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)acetamide|N-[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide|2-Acetamido-2-deoxy-D-glucose|N-Acet...

General Information

Structure

Molecular Formula

C₈H₁₅NO₆

Molecular Mass

221.2078

Exact Mass

221.08993721

Charge

InChI

InChI=1S/C8H15NO6/c1-4(12)9-5(2-10)7(14)8(15)6(13)3-11/h2,5-8,11,13-15H,3H2,1H3,(H,9,12)/t5-,6+,7+,8+/m0/s1

InChIKey

MBLBDJOUHNCFQT-LXGUWJNJSA-N

Canonic Smiles

O=C[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)NC(=O)C

Isomeric Smiles

[C@@H]([C@@H](NC(=O)C)C=O)([C@@H]([C@H](O)CO)O)O

Calculated Properties

JChem

Acid pKa

12.087925

H Acceptors

H Donor

LogD (pH = 5.5)

-3.856396

LogD (pH = 7.4)

-3.8564038

Log P

-3.8563957

Molar Refractivity

48.4469

Polarizability

19.496147

Polar Surface Area

127.09

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

IUPAC Traditional name

N acetylglucosamine

Synonyms

N-((2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)acetamide2-Acetamido-2-deoxy-D-glucoseN-Acetyl-D-glucosamine–Agarose

IUPAC name

N-[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide

Names and Identifiers

Registration numbers

MDL Number

CAS Number

PubChem SID

PubChem CID

Registration numbers

Properties

Product Information

Matrix

6% beaded agarose

Matrix Activation

divinyl sulfone

Matrix Attachment

hydroxyl

Matrix Spacer

5 atoms

Binding Capacity

25-50 mg/mL binding capacity (Triticum vulgaris lectin)

Classification

Derivatives & analogs of Natural Compounds

Description

Ring-Chain Tautomers

Purity

95+%

Physical Property

Apperance

saline suspension

Safety Information

Storage Temperature

2-8°C

German water hazard class

Properties

Related Proteins

No Data Available

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Molecular Spectra

No Data Available

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Molecule Details

Sigma Aldrich

A2278

Application
Used to purify wheat germ (Triticum vulgaris) lectin.
N-Acetyl-D-glucosamine is used in affinity chromatography, protein chromatography and carbohydrate matrices. N-Acetyl-D-glucosamine can be used to purify wheat germ (Triticum vulgaris) lectin.
Physical form
Suspension in 0.15 M NaCl, 0.01 M sodium phosphate, pH 6.8, containing 0.02% sodium azide

Molecule Details

References

PubChem Literature

No Data Available

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References

Bioactivity

PubChem BioAssay

Bioactivity

Names and Identifiers

IUPAC Traditional name

N acetylglucosamine

Synonyms

N-((2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl)acetamide2-Acetamido-2-deoxy-D-glucoseN-Acetyl-D-glucosamine–Agarose

IUPAC name

N-[(2R,3R,4S,5R)-3,4,5,6-tetrahydroxy-1-oxohexan-2-yl]acetamide

Registration numbers

MDL Number

CAS Number

PubChem SID

PubChem CID

Properties

Product Information

Matrix

6% beaded agarose

Matrix Activation

divinyl sulfone

Matrix Attachment

hydroxyl

Matrix Spacer

5 atoms

Binding Capacity

25-50 mg/mL binding capacity (Triticum vulgaris lectin)

Classification

Derivatives & analogs of Natural Compounds

Description

Ring-Chain Tautomers

Purity

95+%

Physical Property

Apperance

saline suspension

Safety Information

Storage Temperature

2-8°C

German water hazard class

Molecule Details

Sigma Aldrich

A2278

References

PubChem Literature

No Data Available

Click here to submit data

Bioactivity

PubChem BioAssay

Molecule

ID:119034