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Isomaltitol

CAT: 1596-AR-M02509-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-M02509-01Size:10 Units
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CAS Number
534-73-6
Synonyms
(2S,3R,4R,5R) -6- (((2S,3R,4S,5S,6R) -3,4,5-trihydroxy-6- (hydroxymethyl) tetrahydro-2H-pyran-2-yl) oxy) hexane-1,2,3,4,5-pentaol; D-Glucitol, 6-O-alpha-D-glucopyranosyl-; (2S,3R,4R,5R) -6- (((2S,3R,4S,5S,6R) -3,4,5-Trihydroxy-6- (hydroxymethyl) tetrahydro-2H-pyran-2-yl) oxy) hexane-1,2,3,4,5-pentaol; D-Glucitol, 6-O-.alpha.-D-glucopyranosyl-;6-O-alpha-D-Glucopyranosyl-D-glucitol; (Mixture of 6-O-alpha-D-Glucopyranosyl-D-glucitol and 1-O-alpha-D-Glucopyranosyl-D-mannitol)
Molecular Formula
C12H24O11
Molecular Weight
344.31
API Name
Maltitol

Chemical Information

Isomaltitol

6-O-alpha-D-glucopyranosyl-D-glucitol is a glycosyl alditol consisting of alpha-D-glucopyranose and D-glucitol residues joined in sequence by a (16)-glycosidic bond. It is a glycosyl alditol and an O-acyl carbohydrate. It is functionally related to a beta-D-glucose and a D-glucitol.

CAS Number534-73-6
PubChem CID94169
IUPAC Name(2S,3R,4R,5R)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexane-1,2,3,4,5-pentol
Molecular FormulaC12H24O11
Molecular Weight344.31
XLogP-5.2
Topological Polar Surface Area201
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count11
Rotatable Bond Count8
Heavy Atom Count23
Formal Charge0
Complexity343
SMILES
C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)O)O)O)O
InChI
InChI=1S/C12H24O11/c13-1-4(15)7(17)8(18)5(16)3-22-12-11(21)10(20)9(19)6(2-14)23-12/h4-21H,1-3H2/t4-,5+,6+,7+,8+,9+,10-,11+,12-/m0/s1
InChIKey
SERLAGPUMNYUCK-YJOKQAJESA-N
Chemical Structure
2D Structure
2D structure of Isomaltitol
CAS: 534-73-6
CID: 94169
Formula: C12H24O11
MW: 344.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight344.31
XLogP3-5.2
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count11
Rotatable Bond Count8
Exact Mass344.13186158
Monoisotopic Mass344.13186158
Topological Polar Surface Area201 Ų
Heavy Atom Count23
Formal Charge0
Complexity343
Isotope Atom Count0
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
AR-M03817-013-O-alfa-D-Glucosyl Isomaltol

Alternative Products

CatalogName
HY-W032970-01Isomaltitol
I821293Isomaltitol (Mixture of 6-O-a-D-Glucopyranosyl-D-glucitol and 1-O-a-D-Glucopyranosyl-D-mannitol)

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