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D-Glucosamine sulfate

CAT: 0926-MG05263-01Size: 25 gDry Ice: NoHazardous: No
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CAT#:0926-MG05263-01Size:25 g
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CAS Number
29031-19-4
Synonyms
Chitosamine Sulphate;2-Amino-2-deoxy-D-glucose sulphate
MDL Number
MFCD00080790
Smiles
C ([C@H] ([C@H] ([C@@H] ([C@H] (C=O) N) O) O) O) O.OS (=O) (=O) O
Molecular Formula
C6H13NO5•H2SO4
Molecular Weight
277.25 g/mol
Controlled
No

Chemical Information

Glucosamine Sulfate

The Expert Panel for Cosmetic Ingredient Safety concluded that Glucosamine Sulfate is safe in cosmetics in the present practices of use and concentration described in this safety assessment when formulated to be non-irritating.

CAS Number29031-19-4
PubChem CID73415774
IUPAC Namebis((2R,3R,4S,5R)-2-amino-3,4,5,6-tetrahydroxyhexanal);sulfuric acid
Molecular FormulaC12H28N2O14S
Molecular Weight456.42
Topological Polar Surface Area331
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count16
Rotatable Bond Count10
Heavy Atom Count29
Formal Charge0
Complexity223
SMILES
C([C@H]([C@H]([C@@H]([C@H](C=O)N)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C=O)N)O)O)O)O.OS(=O)(=O)O
InChI
InChI=1S/2C6H13NO5.H2O4S/c2*7-3(1-8)5(11)6(12)4(10)2-9;1-5(2,3)4/h2*1,3-6,9-12H,2,7H2;(H2,1,2,3,4)/t2*3-,4+,5+,6+;/m00./s1
InChIKey
WLNBMPZUVDTASE-HXIISURNSA-N
Chemical Structure
2D Structure
2D structure of Glucosamine Sulfate
CAS: 29031-19-4
CID: 73415774
Formula: C12H28N2O14S
MW: 456.42
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight456.42
Hydrogen Bond Donor Count12
Hydrogen Bond Acceptor Count16
Rotatable Bond Count10
Exact Mass456.12612474
Monoisotopic Mass456.12612474
Topological Polar Surface Area331 Ų
Heavy Atom Count29
Formal Charge0
Complexity223
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes