3'-Sialyllactosamine

Base Information

• Chemical Name: 3'-Sialyllactosamine
• CAS No.: 126151-66-4
• Molecular Formula: C23H40 N2 O18
• Molecular Weight: 632.5663
• Metabolomics Workbench ID: 38972
• Mol file: 126151-66-4.mol

Synonyms:3'-Sialyllactosamine;3'-SLN;3-Sialyllactosamine;CHEBI:168850;(2S,4S,5R)-2-{[(2S,3R,4S,5S,6R)-2-{[(2R,3S,4R,5R)-5-amino-1,2,4-trihydroxy-6-oxohexan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-5-acetamido-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid;(2S,4S,5R)-5-acetamido-2-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R)-5-amino-1,2,4-trihydroxy-6-oxohexan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid;O-(N-acetyl-alpha-neuraminosyl)-(2->3)-O-beta-D-galactopyranosyl-(1->4)-2-amino-2-deoxy- D-Glucose;O-(N-acetyl-alpha-neuraminosyl)-(2->3)-O-beta-delta-galactopyranosyl-(1->4)-2-amino-2-deoxy- D-Glucose

Chemical Property of 3'-Sialyllactosamine

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1127.3°Cat760mmHg
• Flash Point: 635.6°C
• Density: 1.69g/cm³
• XLogP3: -10
• Hydrogen Bond Donor Count: 13
• Hydrogen Bond Acceptor Count: 19
• Rotatable Bond Count: 15
• Exact Mass: 632.22761243
• Heavy Atom Count: 43
• Complexity: 931

Purity/Quality:

95% ^*data from raw suppliers

3?-Sialyl-N-acetyllactosamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)NC1C(CC(OC1C(C(CO)O)O)(C(=O)O)OC2C(C(OC(C2O)OC(C(CO)O)C(C(C=O)N)O)CO)O)O
• Isomeric SMILES: CC(=O)N[C@@H]1[C@H](C[C@@](OC1[C@@H]([C@@H](CO)O)O)(C(=O)O)O[C@H]2[C@H]([C@H](O[C@H]([C@@H]2O)O[C@H]([C@@H](CO)O)[C@@H]([C@H](C=O)N)O)CO)O)O
• Uses: 3''-Sialyl-N-acetyllactosamine is a human milk oligosaccharide that is a bioactive glycan with notable health benefits.

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