| SpectraBase Spectrum ID |
GKMYUAXSxxk |
| Name |
D-Glucosamine |
| Acquisition Mode |
SIMULTANEOUS |
| CAS Registry Number |
3416-24-8
2351-15-7
58-87-7
58267-75-7 |
| ChEBI ID |
17315 |
| Comments |
100 mM D-Glucosamine hydrochloride - vendor: Acros 119900100; Solvent: D2O; Buffers, etc: 50 mM Sodium Phosphate, 500 uM NaAzide; Temperature=298 K, pH=7.4; NMR Reference: 500 uM DSS; Bruker DMX 400MHz
(Data collected by Madison Metabolomics Consortium) |
| Copyright |
Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Data Source |
Madison Metabolomics Consortium |
| Formula |
C6H13NO5 |
| IUPAC Name |
(2R,3R,4R,5S,6R)-3-amino-6-methylol-tetrahydropyran-2,4,5-triol; (2R,3R,4R,5S,6R)-3-amino-6-(hydroxymethyl)oxane-2,4,5-triol; (2R,3R,4R,5S,6R)-3-amino-6-(hydroxymethyl)tetrahydropyran-2,4,5-triol |
| InChI |
InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6?/m1/s1 |
| InChIKey |
MSWZFWKMSRAUBD-IVMDWMLBSA-N |
| KEGG Compound ID |
C00329 |
| KEGG Pathways |
PATH: map00530 Aminosugars metabolism
PATH: map02060 Phosphotransferase system (PTS) |
| PubChem Compound ID |
18897 |
| SMILES |
C(C1C(C(C(C(O1)O)N)O)O)O |
| Source File Reference |
bmse000247 |
