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Digitoxose

CAT: 0013-GTR19233675-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19233675-01Size:10 mg
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Description
Digitoxose (D- (+) -Digitoxose) is a specific and competitive inhibitor of glucose-stimulated insulin secretion, used in diabetes research. It has been applied in both in vitro studies with pancreatic islets and in vivo experiments in lean and obese mouse models to investigate beta-cell function.
CAS Number
527-52-6
Smiles
[C@H] ([C@H] (CC=O) O) ([C@@H] (C) O) O
Molecular Formula
C6H12O4
Molecular Weight
148.16
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

aldehydo-D-digitoxose

Digitoxose is a dideoxyhexose.

CAS Number527-52-6
PubChem CID94168
IUPAC Name(3S,4R,5R)-3,4,5-trihydroxyhexanal
Molecular FormulaC6H12O4
Molecular Weight148.16
XLogP-1.8
Topological Polar Surface Area77.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count10
Formal Charge0
Complexity104
SMILES
C[C@H]([C@H]([C@H](CC=O)O)O)O
InChI
InChI=1S/C6H12O4/c1-4(8)6(10)5(9)2-3-7/h3-6,8-10H,2H2,1H3/t4-,5+,6-/m1/s1
InChIKey
JWFRNGYBHLBCMB-NGJCXOISSA-N
Chemical Structure
2D Structure
2D structure of aldehydo-D-digitoxose
CAS: 527-52-6
CID: 94168
Formula: C6H12O4
MW: 148.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight148.16
XLogP3-1.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass148.07355886
Monoisotopic Mass148.07355886
Topological Polar Surface Area77.8 Ų
Heavy Atom Count10
Formal Charge0
Complexity104
Isotope Atom Count0
Defined Atom Stereocenter Count3
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
C8171-1Digitoxose
009578-01D-Digitoxose
TRC-D446230-2.5MGD-Digitoxose Tribenzoate
TRC-D445990-50MGD-Digitoxose (>85%)
292965-01Digitoxose discontinued. See 009578
TRC-D445105-1MGDigitoxose 1,3,4-Triacetate
461119-01O- (2-Propenyl) -Digitoxose 3,4-Diacetate

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