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D-Allose

CAT: 0926-MA04055-02Size: 10 gDry Ice: NoHazardous: No
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CAT#:0926-MA04055-02Size:10 g
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CAS Number
2595-97-3
Synonyms
All; b-D-Allose
MDL Number
MFCD00063268
Smiles
C ([C@H] ([C@H] ([C@H] ([C@H] (C=O) O) O) O) O) O
Molecular Formula
C6H12O6
Molecular Weight
180.16 g/mol
Controlled
No

Chemical Information

D-Allose

D-allopyranose is the D-enantiomer of allopyranose. It has a role as an antioxidant. It is a D-allose and an allopyranose. It is an enantiomer of a L-allopyranose.

CAS Number2595-97-3
PubChem CID439507
IUPAC Name(3R,4R,5S,6R)-6-(hydroxymethyl)oxane-2,3,4,5-tetrol
Molecular FormulaC6H12O6
Molecular Weight180.16
XLogP-2.6
Topological Polar Surface Area110
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity151
SMILES
C([C@@H]1[C@H]([C@H]([C@H](C(O1)O)O)O)O)O
InChI
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
InChIKey
WQZGKKKJIJFFOK-IVMDWMLBSA-N
Chemical Structure
2D Structure
2D structure of D-Allose
CAS: 2595-97-3
CID: 439507
Formula: C6H12O6
MW: 180.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight180.16
XLogP3-2.6
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass180.06338810
Monoisotopic Mass180.06338810
Topological Polar Surface Area110 Ų
Heavy Atom Count12
Formal Charge0
Complexity151
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-128741-01D-Allose
GTR19158899-01D- (+) -ALLOSE
sc-221466Aβ-D-Allose
MBS5751347D-(+)-ALLOSE
HY-128741S-01D-Allose-13C
A548000b-D-Allose

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