Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: X2RN3Q8DNE

Structure

InChI Key WQZGKKKJIJFFOK-SVZMEOIVSA-N
Smile OC[C@H]1OC(O)[C@H](O)[C@@H](O)[C@H]1O
InChI
InChI=1S/C6H12O6/c7-1-2-3(8)4(9)5(10)6(11)12-2/h2-11H,1H2/t2-,3+,4+,5-,6?/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H12O6
Molecular Weight 180.16
AlogP -3.22
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 1.0
Polar Surface Area 110.38
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 12.0

Cross References

Resources Reference
ChEBI 4139
ChEMBL CHEMBL195923
EPA CompTox DTXSID0023088
FDA SRS X2RN3Q8DNE
KEGG C00124
PubChem 6036
SureChEMBL SCHEMBL38935