TG6

6-O-phosphono-D-tagatose

Created:2013-07-16
Last modified:  2013-11-27

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Chemical Details

Formal Charge0
Atom Count29
Chiral Atom Count3
Bond Count28
Aromatic Bond Count0
2D diagram of TG6

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Chemical Component Summary

Name6-O-phosphono-D-tagatose
Systematic Name (OpenEye OEToolkits)[(2R,3S,4S)-2,3,4,6-tetrakis(oxidanyl)-5-oxidanylidene-hexyl] dihydrogen phosphate
FormulaC6 H13 O9 P
Molecular Weight260.136
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=P(OCC(O)C(O)C(O)C(=O)CO)(O)O
SMILESCACTVS3.385OCC(=O)[CH](O)[CH](O)[CH](O)CO[P](O)(O)=O
SMILESOpenEye OEToolkits1.7.6C(C(C(C(C(=O)CO)O)O)O)OP(=O)(O)O
Canonical SMILESCACTVS3.385 OCC(=O)[C@@H](O)[C@@H](O)[C@H](O)CO[P](O)(O)=O
Canonical SMILESOpenEye OEToolkits1.7.6 C([C@H]([C@@H]([C@@H](C(=O)CO)O)O)O)OP(=O)(O)O
InChIInChI1.03 InChI=1S/C6H13O9P/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h4-7,9-11H,1-2H2,(H2,12,13,14)/t4-,5-,6+/m1/s1
InChIKeyInChI1.03 GSXOAOHZAIYLCY-PBXRRBTRSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB04277 
NameFructose -6-Phosphate
Groups experimental
SynonymsFructose -6-Phosphate

Drug Targets

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
NameTarget SequencePharmacological ActionActions
Glucosamine-6-phosphate deaminase 1MKVMECQTYEELSQIAARITADTIKEKPDAVLGLATGGTPEGTYRQLIRL...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 5459952
ChEBI CHEBI:47947