N,N',N''-triacetylchitotriose

Base Information

• Chemical Name: N,N',N''-triacetylchitotriose
• CAS No.: 38864-21-0
• Molecular Formula: C24H41 N3 O16
• Molecular Weight: 627.6
• Hs Code.: 29329990
• DSSTox Substance ID: DTXSID20959642
• Nikkaji Number: J490.382J
• Wikidata: Q76010395
• Metabolomics Workbench ID: 39000
• Mol file: 38864-21-0.mol

Synonyms:(G1cNAC)3;N,N',N''- triacetyl chitotriose;N,N',N''-triacetyl chitotriose;N,N',N''-triacetylchitintriose;N,N',N''-triacetylchitotriose;N-acetylchitotriose;O-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1-4)-O-2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1-4)-2-acetamido-2-deoxy-D-glucopyranose;tri(N-acetyl-D-glucosamine);tri-GlcNAc;triGlcNAc;tris(N-acetylglucosamine)

Chemical Property of N,N',N''-triacetylchitotriose

Chemical Property:

• Melting Point: 271-272oC dec.
• Boiling Point: 1146.9 °C at 760 mmHg
• PKA: 12.72±0.70(Predicted)
• Flash Point: 647.4 °C
• PSA: 303.13000
• Density: 1.54 g/cm3
• LogP: -6.12630
• Storage Temp.: −20°C
• Solubility.: H2O: 50 mg/mL, clear to slightly hazy, colorless to faintly
• XLogP3: -7.2
• Hydrogen Bond Donor Count: 11
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 14
• Exact Mass: 627.24868223
• Heavy Atom Count: 43
• Complexity: 944

Purity/Quality:

98%,99%, ^*data from raw suppliers

N,N’,N’’-TriacetylChitotriose ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Biological Agents -> Oligosaccharides
• Canonical SMILES: CC(=O)NC1C(C(C(OC1OC2C(OC(C(C2O)NC(=O)C)OC(C(CO)O)C(C(C=O)NC(=O)C)O)CO)CO)O)O
• Isomeric SMILES: CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@H]1O[C@@H]2[C@H](O[C@H]([C@@H]([C@H]2O)NC(=O)C)O[C@H]([C@@H](CO)O)[C@@H]([C@H](C=O)NC(=O)C)O)CO)CO)O)O
• Uses: N,N',N''-Triacetylchitotriose is a triose oligosaccharide derived from chitin, consisting of three N-acetylglucosamine units. It has been shown to scavenge reactive oxygen species and to protect DNA from oxidative damage. N,N’,N’’-Triacetyl Chitotriose is a multivalent glycosides with strong crosslinking activity for lectin as a specific coagulant.

Technology Process of N,N',N''-triacetylchitotriose

There total 9 articles about N,N',N''-triacetylchitotriose which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ tri(N-acetyl)chitotriose (38864-21-0) + tetra-N-acetyl-chitotetraose (2706-65-2)

Guidance literature:

With hydrogenchloride; Behandeln einer Loesung des Reaktionsprodukts in Methanol mit Acetanhydrid in Gegenwart von Ionenaustauschern;

Reference yield:

colloidal shrimp shell chitin → 2-acetamido-2-deoxy-D-glucose (7512-17-6,282727-46-2,478518-83-1,127959-06-2,78393-48-3) + N,N’-diacetylchitobiose (35061-50-8) + tri(N-acetyl)chitotriose (38864-21-0)

Guidance literature:

With chitinase from Humicola grisea ITCC 10,360.16; In aq. buffer; at 70 ℃; pH=3.0; Kinetics; Enzymatic reaction;

DOI:10.1016/j.ijbiomac.2018.05.125

Reference yield:

→ tri(N-acetyl)chitotriose (38864-21-0)

Guidance literature:

With hydrogenchloride; Behandeln einer Loesung des Reaktionsprodukts in Methanol mit Acetanhydrid in Gegenwart von Ionenaustauschern;

Refernces