Grundinformationen
- Standard-SMILES
CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O- InChIKey
OVRNDRQMDRJTHS-RTRLPJTCSA-N- Summenformel
- C8H15NO6
- Durchschnittliche Molmasse
- 221,21 g/mol
- Monoisotopische Masse
- 221,0899372
Überblick
N-acetyl-D-glucosamine is the D isomer of N-acetylglucosamine. It has a role as a bacterial metabolite. It is a N-acetyl-D-hexosamine and a N-acetylglucosamine.
Namen und Bezeichner
- Bevorzugter Name
- N-Acetyl-D-Glucosamine
- IUPAC
- N-[(3R,4R,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
Namen und Synonyme
2-acetamido-2-deoxy-D-glucopyranoseGlcNAc2-Deoxy-2-Acetamido-D-Glucopyranosen-acetyl-glucosamine2-acetamido-2-deoxy-glucose2-Deoxy-2-Acetamido-Glucose2-Acetamido-2-Deoxy-Glucopyranose2-Deoxy-2-Acetamido-Glucopyranose2-acetamido-2-deoxy-glucopyranoside2-Deoxy-2-Acetamido-Glucopyranoside2-acetamido-2-deoxy-D-glucopyranoside2-Deoxy-2-Acetamido-D-Glucopyranoside
Weitere Namen anzeigen
2-Acetamido-2-Deoxy-D-Glucose2-Deoxy-2-Acetamido-D-GlucoseD-GlcNAcGlcNAc (SNFG)N-Acetyl-D-GlucosamineSNFG:GlcNAcN-AcetylchitosamineN-Acetyl-D-glucosamine-Agarose
Datenbank-Bezeichner
- CAS
7512-17-6- PubChem CID
- 439174
- DTXSID
DTXSID901045903- ChEMBL
CHEMBL240524- ChEBI
CHEBI:506227- Nikkaji
- J35.752I
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -1,7
- Polarare Oberfläche (TPSA)
- 119 Ų
- H-Brücken-Donoren
- 5
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 15
- Formalladung
- 0
- Komplexität
- 235
Experimentelle und physikochemische Eigenschaften
LogP-2.1
Solubility
167 mg/mL
>33.2 [ug/mL] (The mean of the results at pH 7.4)
Melting Point210 °C
Physical DescriptionSolid
Collision Cross Section
147.3 Ų [M+H]+ [CCS Type: DT; Method: single field calibrated with Agilent tune mix (Agilent)]
160.36 Ų [M+Na]+ [CCS Type: DT; Method: stepped-field]
Chemie und Industrie
Pharmakologische Informationen
Tissue LocationsIntestine
Cellular LocationsCytoplasm
Metabolite PathwaysAmino Sugar Metabolism
Zugehörige Reaktionen
38
Verknüpfte Notizen
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