LGC

D-glucono-1,5-lactone

Created: 2000-08-25
Last modified:  2020-07-17

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Chemical Details

Formal Charge0
Atom Count22
Chiral Atom Count4
Bond Count22
Aromatic Bond Count0
2D diagram of LGC

Chemical Component Summary

NameD-glucono-1,5-lactone
Synonyms(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)TETRAHYDRO-2H-PYRAN-2-ONE; GLUCONOLACTONE
Systematic Name (OpenEye OEToolkits)(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-one
FormulaC6 H10 O6
Molecular Weight178.14
TypeD-SACCHARIDE

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C1OC(CO)C(O)C(O)C1O
SMILESCACTVS3.341OC[CH]1OC(=O)[CH](O)[CH](O)[CH]1O
SMILESOpenEye OEToolkits1.5.0C(C1C(C(C(C(=O)O1)O)O)O)O
Canonical SMILESCACTVS3.341 OC[C@H]1OC(=O)[C@H](O)[C@@H](O)[C@@H]1O
Canonical SMILESOpenEye OEToolkits1.5.0 C([C@@H]1[C@H]([C@@H]([C@H](C(=O)O1)O)O)O)O
InChIInChI1.03 InChI=1S/C6H10O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-5,7-10H,1H2/t2-,3-,4+,5-/m1/s1
InChIKeyInChI1.03 PHOQVHQSTUBQQK-SQOUGZDYSA-N

Drug Info: DrugBank

DrugBank IDDB04564 
NameGluconolactone
Groups
  • approved
  • experimental
DescriptionGluconolactone is a naturally-occurring food additive used as a sequestrant, an acidifier, or a curing, pickling, or leavening agent. It is a cyclic ester of D-gluconic acid. Pure gluconolactone is a white odorless crystalline powder.
Synonyms
  • Gluconolactone
  • Gluconic acid lactone
  • D-glucono-1,5-lactone
  • 1,5-Gluconolactone
  • delta-gluconolactone
Brand NamesRenacidin
Categories
  • Acids, Acyclic
  • Calculi Dissolution Agent
  • Carbohydrates
  • Hydroxy Acids
  • Irrigation
CAS number90-80-2

Drug Targets

NameTarget SequencePharmacological ActionActions
Lactase-phlorizin hydrolaseMELSWHVVFIALLSFSCWGSDWESDRNFISTAGPLTNDLLHNLSGLLGDQ...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 7027
ChEMBL CHEMBL1200829
ChEBI CHEBI:16217
CCDC/CSD GLULAC10