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2-Amino-2-deoxy-6-O-sulfohexopyranose

HCID 453620
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Basic information

CAS
91674-26-9
Standard SMILES
NC1C(O)OC(COS(=O)(=O)O)C(O)C1O
InChIKey
MTDHILKWIRSIHB-UHFFFAOYSA-N
Molecular formula
C6H13NO8S
Average molar mass
259.24 g/mol
Monoisotopic mass
259.03618755

Names & identifiers

Preferred name
2-Amino-2-deoxy-6-O-sulfohexopyranose
IUPAC
(5-amino-3,4,6-trihydroxyoxan-2-yl)methyl hydrogen sulfate
English name
D-Glucosamine 6-sulfate
Molecular formula
C6H13NO8S
Molecular weight
259.23

Names & synonyms

RefChem:935406GlyTouCan:G53534GFDTXCID40817114DTXSID50869083G53534GF2-Amino-2-deoxy-6-O-sulfohexopyranoseD-Glucosamine-6-sulfate(5-amino-3,4,6-trihydroxyoxan-2-yl)methyl hydrogen sulfateD-Galactosamine-6-O-sulphateGlucosamine-6-sulfateLS-13204(5-amino-3,4,6-trihydroxy-tetrahydropyran-2-yl)methyl hydrogen sulfate
Show more names
GLUCOSAMINE SULPHATEGlucosamine 6-sulfateGLCN-6Sglucosamine 6-O-sulfateD-GLUCOSAMINE 6-SULFATEGlucosamine Sulphate PowderD-Glucosamine-6-sulfate, FreeBaseD-glucosamine 6-sulfate free base2-Amino-2-deoxy-D-glucose 6-sulfateD-Glucose, 2-amino-2-deoxy-, 6-(hydrogen sulfate)

Database identifiers

CAS
91674-26-9
PubChem CID
453620

Properties

Computed structural properties

XLogP
-6.1
Topological polar surface area
168 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
9
Rotatable bonds
3
Heavy atoms
16
Formal charge
0
Complexity
326

Physicochemical properties

Melting point
160 · 160-162℃
Density
1.757 · 1.757±0.06 g/cm3(Predicted)
storage temp.
-20 °C · Keep in dark place,Inert atmosphere,Store in freezer, under -20°C
solubility
DMSO (Slightly), Water (Slightly)
form
Solid
pka
-3.61 · -3.61±0.18(Predicted)
color
White to Off-White
Stability
Hygroscopic
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
Hazard Codes
Xn,Xi
Risk Statements
21 · 21-36/38-46-62-63
Safety Statements
25 · 25-26-36/37-53
WGK Germany
3 · 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

wgk
3
hs_code
29329985
risk_code
21-36/38-46-62-63
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xn,Xi
safety_code
25-26-36/37-53
Hazard statements
H302-H315-H319-H335
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

UsesGlucosamine 6-sulfate (GlcN6P) is an organic cofactor that splits phosphodiester bonds. Glucosamine 6-sulfate plays a variety of catalytic roles in glmS ribozymes[1].

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Compound notes

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HS Code
29329985 · 29329985