[3H]2-deoxyglucose   Click here for help

GtoPdb Ligand ID: 4643

Synonyms: 2-deoxy-D-glucose | 2-DG | [3H]-2-deoxyglucose
 Ligand is labelled  Ligand is radioactive
Compound class: Synthetic organic
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 4
Rotatable bonds 1
Topological polar surface area 90.15
Molecular weight 164.07
XLogP -1.52
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES OCC1OC(O)CC(C1O)O
Isomeric SMILES OC[C@H]1OC(O)C[C@H]([C@@H]1O)O
InChI InChI=1S/C6H12O5/c7-2-4-6(10)3(8)1-5(9)11-4/h3-10H,1-2H2/t3-,4-,5?,6+/m1/s1
InChI Key PMMURAAUARKVCB-CERMHHMHSA-N
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
(4R,5S,6R)-6-(hydroxymethyl)oxane-2,4,5-triol
Synonyms Click here for help
2-deoxy-D-glucose | 2-DG | [3H]-2-deoxyglucose
Database Links Click here for help
ChEMBL Ligand CHEMBL1377788
GtoPdb PubChem SID 178101360
PubChem CID 439268
Search Google for chemical match using the InChIKey PMMURAAUARKVCB-CERMHHMHSA-N
Search Google for chemicals with the same backbone PMMURAAUARKVCB
Search UniChem for chemical match using the InChIKey PMMURAAUARKVCB-CERMHHMHSA-N
Search UniChem for chemicals with the same backbone PMMURAAUARKVCB
Wikipedia 2-Deoxy-D-glucose

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Tocris
2-Deoxy-D-glucose
Cat. No. 4515