Structure

InChI Key HEBKCHPVOIAQTA-SCDXWVJYSA-N
Smile OC[C@H](O)[C@@H](O)[C@H](O)CO
InChI
InChI=1S/C5H12O5/c6-1-3(8)5(10)4(9)2-7/h3-10H,1-2H2/t3-,4+,5+

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H12O5
Molecular Weight 152.15
AlogP -2.95
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 4.0
Polar Surface Area 101.15
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 10.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Otitis Media 3 D010033 ClinicalTrials
Severe Acute Respiratory Syndrome 3 D045169 ClinicalTrials
Dental Caries 3 D003731 ClinicalTrials
Otitis Media with Effusion 2 D010034 ClinicalTrials
Diabetes Mellitus 2 D003920 ClinicalTrials
Sinusitis 2 D012852 ClinicalTrials
Bacterial Infections 1 D001424 ClinicalTrials
Cystic Fibrosis 1 D003550 ClinicalTrials

Cross References

Resources Reference
CAS NUMBER 87-99-0
ChEBI 17151
ChEMBL CHEMBL96783
DrugBank DB11195
DrugCentral 4604
EPA CompTox DTXSID7042514
FDA SRS VCQ006KQ1E
KEGG C00379
PDB XYL
SureChEMBL SCHEMBL4250
ZINC ZINC000100018612