General Information of Drug (ID: DMNX5VI)

Drug Name
D-fructose
Synonyms
D-Arabino-Hex-2-ulo-Pyranose; D-Fructopyranose; D-Fructopyranoside; D-Fructose; D-arabino-Hex-2-ulopyranose; Fructopyranose; Fructopyranoside; Fructose; LKDRXBCSQODPBY-VRPWFDPXSA-N; Q27117234; SCHEMBL239448; AKOS004910390; C05003; CHEBI:37714; CHEMBL2325229; CTK2F9011; D-Fru; EB37038E-44A6-4AF7-B0D8-47A315AD2F74; F0317; Fru; [14C]-Fructose
Structure
3D MOL 2D MOL
#Ro5 Violations (Lipinski): 1 Molecular Weight (mw) 180.16
Logarithm of the Partition Coefficient (xlogp) -2.8
Rotatable Bond Count (rotbonds) 1
Hydrogen Bond Donor Count (hbonddonor) 5
Hydrogen Bond Acceptor Count (hbondacc) 6
Chemical Identifiers
Formula
C6H12O6
IUPAC Name
(3S,4R,5R)-2-(hydroxymethyl)oxane-2,3,4,5-tetrol
Canonical SMILES
C1C(C(C(C(O1)(CO)O)O)O)O
InChI
LKDRXBCSQODPBY-VRPWFDPXSA-N
InChIKey
1S/C6H12O6/c7-2-6(11)5(10)4(9)3(8)1-12-6/h3-5,7-11H,1-2H2/t3-,4-,5+,6?/m1/s1
Cross-matching ID
PubChem CID
2723872
ChEBI ID
CHEBI:37714
CAS Number
7660-25-5
UNII
0LJG9X2ZUL
DrugBank ID
DB02561
INTEDE ID
DR2156

Molecular Interaction Atlas of This Drug


Drug-Metabolizing Enzyme (DME)
DME Name DME ID UniProt ID MOA REF
D-psicose 3-epimerase (DPEase)
Main DME
DEA2SU9 DPES_RUMCH Substrate [1], [2]
Molecular Interaction Atlas (MIA) Jump to Detail Molecular Interaction Atlas of This Drug

References

1 Highly efficient production of Clostridium cellulolyticum H10 D-psicose 3-epimerase in Bacillus subtilis and use of these cells to produce D-psicose. Microb Cell Fact. 2018 Nov 28;17(1):188.
2 Anaerobic bacteria as producers of antibiotics. Appl Microbiol Biotechnol. 2012 Oct;96(1):61-7.