Ligand
Ligand Name:   D-fructose
Ligand Type:   saccharide
Ligand ID:   COVPDB812 PubChem:   439709
Synonym(s):  
  •   beta-d-fructofuranose
  • beta-d-fructose
  • beta-levulose
  • beta-fruit sugar
  • 470-23-5
  • chebi:28645
  • beta-d-arabino-hexulose
  • (2r,3s,4s,5r)-2,5-bis(hydroxymethyl)oxolane-2,3,4-triol
  • unii-b986vtp17j
  • b986vtp17j
  • fructooligosaccharides
  • dsstox_cid_3081
  • 53188-23-1
  • beta-d-fructofuranose (closed ring structure)
  • dsstox_rid_76866
  • dsstox_gsid_23081
  • .beta.-d-fructofuranose
  • cas-57-48-7
  • frutooligosaccharides
  • dietade dietary foods
  • 2x7x
  • fructose, furanose form
  • schembl3966
  • (2->1)-beta-d-fructan
  • (2,1-beta-d-fructosyl)n
  • topiramate impurity, fructose-
  • chembl604608
  • chebi:29084
  • dtxsid60859011
  • pharmakon1600-01301021
  • zinc1529270
  • tox21_113557
  • tox21_200762
  • (2r,3s,4s,5r)-2,5-bis(hydroxymethyl)tetrahydrofuran-2,3,4-triol
  • bdbm50249032
  • nsc760385
  • akos026676646
  • nsc-760385
  • ncgc00248823-01
  • ncgc00258316-01
  • st50407024
  • c02336
  • j-500988
  • q27103808
  • f8889-8688
  • unii-ed959s6acy component rfsuneuaizkajo-arqdhwqxsa-n
  • unii-xy6un3qb6s component rfsuneuaizkajo-arqdhwqxsa-n
  • unii-yuh1c99228 component rfsuneuaizkajo-arqdhwqxsa-n
  • (2r,3s,4s,5r)-2,5-bis(hydroxymethyl)-oxolane-2,3,4-triol
show 48 synonym(s)
DrugBank:   - ChEMBL:   CHEMBL604608
Canonical SMILES:   O[C@H]1[C@H](O)[C@@H](CO)O[C@]1(O)CO
Standard InChI:   InChI=1S/C6H12O6/c7-1-3-4(9)5(10)6(11,2-8)12-3/h3-5,7-11H,1-2H2/t3-,4-,5+,6-/m1/s1
Molecular Formula:   C6H12O6 Mol. Weight:   180.06339 logP:   -3.2198
HBD:   5 HBA:   6
#Rotatable Bonds:   2 TPSA:   110.38

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
Hemoglobin subunit alpha P69905 (HBA_HUMAN) Homo sapiens (Human) 3B75 FRU
-
-
SHOW
Hemoglobin subunit alpha P69905 (HBA_HUMAN) Homo sapiens (Human) 5HY8 FRU
-
-
SHOW