N-Acetyl-D-galactosamine 4-sulfate

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Systematic / IUPAC Name: 2-Acetamido-2-deoxy-4-O-sulfo-β-D-galactopyranose

ID: Reference1476

Other Names: 2-(Acetylamino)-2-deoxy-D-galactose 4-(hydrogen sulfate);
N-Acetyl-D-galactosamine 4-sulfate;
N-Acetylgalactosamine 4-sulfate;
N-Acetylgalactosamine-4-sulphate

Formula: C8H15NO9S

Class: Endogenous Metabolites

Spectral Data

N-Acetyl-D-galactosamine 4-sulfate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 313
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods ESI
Analyzers FT
Last Modification 12/3/2014 10:55:20 AM
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Identificators

InChI InChI=1S/C8H15NO9S/c1-3(11)9-5-6(12)7(18-19(14,15)16)4(2-10)17-8(5)13/h4-8,10,12-13H,2H2,1H3,(H,9,11)(H,14,15,16)/t4-,5-,6-,7+,8-/m1/s1
InChI Key WHCJUIFHMJFEFZ-UIAUGNHASA-N
Canonical SMILES CC(=O)NC1C(C(C(OC1O)CO)OS(=O)(=O)O)O
CAS 45233430
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Other Names 2-(Acetylamino)-2-deoxy-D-galactose 4-(hydrogen sulfate);
N-Acetyl-D-galactosamine 4-sulfate;
N-Acetylgalactosamine 4-sulfate;
N-Acetylgalactosamine-4-sulphate

In Other Databases

HMDb HMDB00781
PubChem 446101
ChemSpider 393546