Compound Summary
Thiocitrulline
Compound Information
Thiocitrulline
Compound Name: | Thiocitrulline |
Compound CID: | 3353976 |
Synonyms: | Thiocitrulline N5-(Aminothioxomethyl)-L-ornithine 2-amino-5-(carbamothioylamino)pentanoic acid Lopac0_001244 SCHEMBL3276661 More... |
Iupac Name: | 2-amino-5-(carbamothioylamino)pentanoic acid |
InChI: | InChI=1S/C6H13N3O2S/c7-4(5(10)11)2-1-3-9-6(8)12/h4H,1-3,7H2,(H,10,11)(H3,8,9,12) |
InChIKey: | BKGWACHYAMTLAF-UHFFFAOYSA-N |
Canonical Smiles: | C(CC(C(=O)O)N)CNC(=S)N |
Isomeric Smiles: | C(CC(C(=O)O)N)CNC(=S)N |
Molecular Weight: | 191.25 |
Molecular Formula: | C6H13N3O2S |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Thiocitrulline
Molecular Weight: | 191.25 |
Molecular Formula: | C6H13N3O2S |
Hydrogen Bond Donor Count: | 4 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 5 |
Heavy Atom Count: | 12 |
Complexity: | 174 |
Synonyms
Thiocitrulline
| Thiocitrulline | Thiocitrulline |
|---|---|
Thiocitrulline |
N5-(Aminothioxomethyl)-L-ornithine |
2-amino-5-(carbamothioylamino)pentanoic acid |
Lopac0_001244 |
SCHEMBL3276661 |
CHEMBL1608298 |
CHEBI:139389 |
CCG-205318 |
NCGC00015991-02 |
NCGC00015991-03 |
NCGC00094485-01 |
NCGC00094485-02 |
EU-0101244 |
T-173 |
SR-01000075525 |
SR-01000075525-1 |
Experimental Data
Thiocitrulline
| 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 | 33.000000000000000 | umol/L | 1.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
Thiocitrulline
Statistics Data
Thiocitrulline
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 1.000000000000000 | 1 | 1 |
Statistics Data Visualization
Thiocitrulline
