ChEMBL logo

ChEMBL

spacer
ChEMBL Statistics
  Loading Statistics...
spacer

Compound Report Card

Compound Name and Classification

Compound ID CHEMBL300520
CHEMBL300520
Compound Name b-D-GALACTOSE
ChEMBL Synonyms Galactose
Max Phase 0
Trade Names
Molecular Formula C6H12O6

Additional synonyms for CHEMBL300520 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O
Standard InChI InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2 ...
Download InChI
Standard InChI Key WQZGKKKJIJFFOK-FPRJBGLDSA-N

Structural Alerts

There are 1 structural alerts for CHEMBL300520. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL300520

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
180.2 180.0634 -2.51 1 110.38 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
6 5 0 6 5 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
12.12 - -2.49 -2.49 0 12 0.31

Compound Cross References

ChemSpider ChemSpider:WQZGKKKJIJFFOK-FPRJBGLDSA-N
Wikipedia Galactose

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL300520



ACToR 7296-64-2
BindinDB 50077229
ChEBI 27667
FDA SRS RQ6K52J67A
Human Metabolome Database HMDB03449
IBM Patent System F737A50A8CE3457443BAF9722182894B
IBM Patents US20020152489 US5498539 EP0456986B1 US6162610 US20080034453 US20040170960 EP2168976A1 US7279294 EP2075002A2 EP0337799A2 WO2009133036A1 US6548484 US20020028782 EP2111462A2 US20030073077 EP1724278A1 US20090270320 EP1945772A1 US7820396 EP0308208B1 US7064197 US4330528 US20060041947 US20050214944 EP0254051B1 EP1549759B1 US5605795 US20090192177 EP0248637A2 EP0326550A1 US20020192189 US20020094541 US20030013076 US20040067996 US20050070698 US5183743 WO2002010453A2 EP0497613B1 EP0062277A1 US6538173 US20100304418 US5830912 US20100234762 US20030100535 US7759304 US4810636 US5707559 US20100166656 WO2010022089A2 WO2004034012A2 US5236837 EP0610745A3 US6291642 EP0271838A2 WO2008123918A1 WO2001002609A2 US7307152 WO2006097107A1 US20030054441 US20060030020 EP0287030B1 US7655224 US20080015149 EP2115460A1 US20100266607 US6635468 EP1484111A1 US5096925 US7220732 US4859589 US20030082542 US20080319173 EP0970114A1 US5210077 EP2090305A1 US6342365 US20080029392 EP2055718A1 US20100129844 US4560648 US4327073 EP0610743A1 WO2006064487A1 US20070031391 EP1694702B1 US4366241 WO1999028464A2 WO2010056075A2 US20030235813 US20060099688 EP0852012B1 US4686193 US7601348 US4927752 US7169906 EP1945186A2 US5772926 US20100113569 US20100173373 US20070185197
KEGG Ligand C00962
Nikkaji J292.886H
PDBe GAL
PubChem 439353
PubChem: Thomson Pharma 14772727
SureChEMBL SCHEMBL42465
ZINC ZINC02597049

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/WQZGKKKJIJFFOK-FPRJBGLDSA-N spacer
spacer