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D-Glucose-3,4-13C2

CAT: 0926-SCA75925-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0926-SCA75925-01Size:25 mg
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CAS Number
67759-25-5
Smiles
C (C (C (C (C (C=O) O) O) O) O) O
Molecular Formula
C6H12O6
Molecular Weight
182.14 g/mol
Controlled
No

Chemical Information

GlyTouCan:G09597LJ

Aldohexose is a hexose with a (potential) aldehyde group at one end. It is an aldose and a hexose.

CAS Number67759-25-5
PubChem CID24749
IUPAC Name2,3,4,5,6-pentahydroxyhexanal
Molecular FormulaC6H12O6
Molecular Weight180.16
XLogP-2.9
Topological Polar Surface Area118
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity138
SMILES
C(C(C(C(C(C=O)O)O)O)O)O
InChI
InChI=1S/C6H12O6/c7-1-3(9)5(11)6(12)4(10)2-8/h1,3-6,8-12H,2H2
InChIKey
GZCGUPFRVQAUEE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of GlyTouCan:G09597LJ
CAS: 67759-25-5
CID: 24749
Formula: C6H12O6
MW: 180.16
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight180.16
XLogP3-2.9
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass180.06338810
Monoisotopic Mass180.06338810
Topological Polar Surface Area118 Ų
Heavy Atom Count12
Formal Charge0
Complexity138
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes