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Dextrose-13C6

HCID 12285877
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Basic information

CAS
74134-89-7
Standard SMILES
O[13CH2][13C@H]1O[13C@H](O)[13C@H](O)[13C@@H](O)[13C@@H]1O
InChIKey
WQZGKKKJIJFFOK-YPYOLYKNSA-N
Molecular formula
C6H12O6
Average molar mass
186.11 g/mol
Monoisotopic mass
186.08351711

Names & identifiers

Preferred name
Dextrose-13C6
IUPAC
(2S,3R,4S,5S,6R)-6-(hydroxy(113C)methyl)(2,3,4,5,6-13C5)oxane-2,3,4,5-tetrol
English name
D-[UL-13C6]GALACTOSE
Molecular formula
C6H12O6
Molecular weight
186.11

Names & synonyms

Dextrose-13C6DTXSID30484450RefChem:336831DTXCID3043526074134-89-7D-[UL-13C6]galactose(2S,3R,4S,5S,6R)-6-(hydroxy(113C)methyl)(2,3,4,5,6-13C5)oxane-2,3,4,5-tetrolSCHEMBL29532937478518-66-0alpha-D-(~13~C_6_)GlucopyranoseMFCD01075538D-Galactose-13C6
Show more names
UL-13C6]-D-galactoseD-Galactose-[UL-13C6]D-Galactose-13C6 (9CI)D-Galactose (U-13C?, 99%)D-Galactose-13C6 (Standard)D-Galactose-13C6

Database identifiers

CAS
74134-89-7
PubChem CID
12285877
DTXSID
DTXSID30484450
Nikkaji
J796.060C

Properties

Computed structural propertiesFilling in

XLogP
-2.6
Topological polar surface area
110 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
6
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
151

Physicochemical properties

Melting point
169 · 169-170 °C(lit.)
Density
1.581 · 1.581±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
storage temp.
Refrigerator
solubility
Methanol (Slightly), Water (Slightly)
form
Solid
color
White to Off-White
optical activity
25 · [α]25/D +79.0, c =2 in H2O (trace NH4OH)
InChI
1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6/m1/s1/i1+1,2+1,3+1,4+1,5+1,6+1
InChIKey
WQZGKKKJIJFFOK-QCUDSKIKSA-N
SMILES
O[13CH2][13C@H]1O[13CH](O)[13C@H](O)[13C@@H](O)[13C@H]1O
UNSPSC Code
12352005 · 12352005
CAS Number Unlabeled
59 · 59-23-4
WGK Germany
3 · WGK 3
Storage Class
11 · 11 - Combustible Solids

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
WGK 3
Storage Class
11 - Combustible Solids

Chemistry & industry

Applications · 2 items

UsesIsotope labelled D-galactose (G155250), A C-4 epimer of Glucose (G595000) found in milk and sugar beets as well as being synthesized by the body. Potential use in oral therapy for nephrotic syndrome in focal and segmental glomerulosclerosis.

UsesD-Galactose-13C6,Potential use in oral therapy for nephrotic syndrome in focal and segmental glomerulosclerosis.

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Compound notes

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