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Isomaltose

CAT: 1596-AR-M02940-02Size: 50 UnitsDry Ice: NoHazardous: No
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CAS Number
499-40-1
Synonyms
(2R,3S,4R,5R) -2,3,4,5-tetrahydroxy-6- (((2S,3R,4S,5S,6R) -3,4,5-trihydroxy-6- (hydroxymethyl) tetrahydro-2H-pyran-2-yl) oxy) hexanal; 6-O-α-D-glucopyranosyl-D-Glucose
Molecular Formula
C12H22O11
Molecular Weight
342.30
API Name
Maltose

Chemical Information

Isomaltose

Isomaltose is a glycosylglucose consisting of two D-glucopyranose units connected by an alpha-(16)-linkage. It has a role as a metabolite, a mouse metabolite and a human metabolite.

CAS Number499-40-1
PubChem CID439193
IUPAC Name(3R,4S,5S,6R)-6-[[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol
Molecular FormulaC12H22O11
Molecular Weight342.30
XLogP-4.7
Topological Polar Surface Area190
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Heavy Atom Count23
Formal Charge0
Complexity382
SMILES
C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H](C(O2)O)O)O)O)O)O)O)O
InChI
InChI=1S/C12H22O11/c13-1-3-5(14)8(17)10(19)12(23-3)21-2-4-6(15)7(16)9(18)11(20)22-4/h3-20H,1-2H2/t3-,4-,5-,6-,7+,8+,9-,10-,11?,12+/m1/s1
InChIKey
DLRVVLDZNNYCBX-RTPHMHGBSA-N
Chemical Structure
2D Structure
2D structure of Isomaltose
CAS: 499-40-1
CID: 439193
Formula: C12H22O11
MW: 342.30
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight342.30
XLogP3-4.7
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count11
Rotatable Bond Count4
Exact Mass342.11621151
Monoisotopic Mass342.11621151
Topological Polar Surface Area190 Ų
Heavy Atom Count23
Formal Charge0
Complexity382
Isotope Atom Count0
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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TRC-I821246-50MGIsomaltose-13C Octabenzoate
RM-I191200-01Isomaltose; Glucose EP Impurity B
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