Compound Summary
Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose
Compound Information
Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose
Compound Name: | Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose |
Compound CID: | 155818889 |
Synonyms: | Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose N-(1R,2R,3S,4R,6S)-2,3-dihydroxy-4-(hydroxymethyl)-6-(methylsulfanyl)cyclohexylacetamide Q3M More... |
Iupac Name: | N-[(1R,2R,3S,4R,6S)-2,3-dihydroxy-4-(hydroxymethyl)-6-methylsulfanylcyclohexyl]acetamide |
InChI: | InChI=1S/C10H19NO4S/c1-5(13)11-8-7(16-2)3-6(4-12)9(14)10(8)15/h6-10,12,14-15H,3-4H2,1-2H3,(H,11,13)/t6-,7+,8+,9+,10-/m1/s1 |
InChIKey: | ZYKRTEHWXBHGOU-SQQIUAQRSA-N |
Canonical Smiles: | CC(=O)NC1C(CC(C(C1O)O)CO)SC |
Isomeric Smiles: | CC(=O)N[C@H]1[C@H](C[C@@H]([C@@H]([C@@H]1O)O)CO)SC |
Molecular Weight: | 249.33 |
Molecular Formula: | C10H19NO4S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose
Molecular Weight: | 249.33 |
Molecular Formula: | C10H19NO4S |
Hydrogen Bond Donor Count: | 4 |
Hydrogen Bond Acceptor Count: | 5 |
Rotatable Bond Count: | 3 |
Heavy Atom Count: | 16 |
Complexity: | 251 |
Synonyms
Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose
| Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose | Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose |
|---|---|
Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose |
N-(1R,2R,3S,4R,6S)-2,3-dihydroxy-4-(hydroxymethyl)-6-(methylsulfanyl)cyclohexylacetamide |
Q3M |
Experimental Data
Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 20.000000000000000 | ug/mL | 22.500000000000000 | 27.200000000000000 | 0.210000000000000 | S | N2 | 21563825 | Active |
Experimental Data Visualization
Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose
Statistics Data
Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 0.210000000000000 | 1 | 1 |
Statistics Data Visualization
Methyl 2-(acetylamino)-2-deoxy-1-thio-alpha-D-galactopyranose
