GLUCOSAMINE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Parent
ATC: M01AX05
UNII: N08U5BOQ1K

Structure
InChI Key MSWZFWKMSRAUBD-IVMDWMLBSA-N
Smile N[C@H]1C(O)O[C@H](CO)[C@@H](O)[C@@H]1O
InChI
InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4-,5-,6?/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H13NO5
Molecular Weight 179.17
AlogP -3.25
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 1.0
Polar Surface Area 116.17
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 12.0

Pharmacology

Action Mechanism of Action Reference
None Supplement PubMed DailyMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC22 family of organic cation and anion transporters
- - - - 14

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Irritable Bowel Syndrome 3 D043183 ClinicalTrials
Osteoarthritis 3 D010003 ClinicalTrials
Osteoarthritis, Knee 3 D020370 ClinicalTrials
Breast Neoplasms 2 D001943 ClinicalTrials
Obesity 1 D009765 ClinicalTrials

Related Entries

Salt
Salt

Cross References

Resources Reference
CAS NUMBER 3416-24-8
ChEBI 47977
ChEMBL CHEMBL493287
DrugBank DB01296
DrugCentral 1307
FDA SRS N08U5BOQ1K
Human Metabolome Database HMDB0001514
KEGG C00329
PharmGKB PA164747613
PubChem 3034366
SureChEMBL SCHEMBL167831
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