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1,5-Anhydrosorbitol

CAT: 0804-HY-113075-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-113075-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
1,5-Anhydrosorbitol is a short-term marker for glycemic control.
CAS Number
154-58-5
Product Name Alternative
1,5-Anhydro-D-glucitol
UNSPSC
12352005
Hazard Statement
H302, H315, H319, H335
Target
Endogenous Metabolite
Type
Natural Products
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/1,5-Anhydrosorbitol.html
Concentration
10mM
Purity
99.57
Solubility
H2O : 50 mg/mL (ultrasonic; warming; heat to 60°C)
Smiles
OC[C@@H]1[C@@H](O)[C@H](O)[C@H](CO1)O
Molecular Formula
C6H12O5
Molecular Weight
164.16
Precautions
H302, H315, H319, H335
References & Citations
[1]Vaarhorst AA, et al. A metabolomic profile is associated with the risk of incident coronary heart disease. Am Heart J. 2014 Jul;168 (1) :45-52.e7.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Natural Products
Clinical Information
No Development Reported
Isoform
Human Endogenous Metabolite

Chemical Information

1,5-Anhydroglucitol

1,5-anhydro-D-glucitol is an anhydro sugar of D-glucitol. It has a role as a human metabolite. It is functionally related to a D-glucitol.

CAS Number154-58-5
PubChem CID64960
IUPAC Name(2R,3S,4R,5S)-2-(hydroxymethyl)oxane-3,4,5-triol
Molecular FormulaC6H12O5
Molecular Weight164.16
XLogP-2.1
Topological Polar Surface Area90.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity128
SMILES
C1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChI
InChI=1S/C6H12O5/c7-1-4-6(10)5(9)3(8)2-11-4/h3-10H,1-2H2/t3-,4+,5+,6+/m0/s1
InChIKey
MPCAJMNYNOGXPB-SLPGGIOYSA-N
Chemical Structure
2D Structure
2D structure of 1,5-Anhydroglucitol
CAS: 154-58-5
CID: 64960
Formula: C6H12O5
MW: 164.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight164.16
XLogP3-2.1
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass164.06847348
Monoisotopic Mass164.06847348
Topological Polar Surface Area90.2 Ų
Heavy Atom Count11
Formal Charge0
Complexity128
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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