Compound Summary
alpha,beta-Methylene adenosine 5\'-triphosphate dilithium
Compound Information
alpha,beta-Methylene adenosine 5'-triphosphate dilithium
Compound Name: | alpha,beta-Methylene adenosine 5'-triphosphate dilithium |
Compound CID: | 11957603 |
Synonyms: | "alpha,beta-Methylene adenosine 5-triphosphate dilithium HMS3262G20 CCG-222063 LP00759 EU-0100759 More... |
Iupac Name: | dilithium;[[[(2R,3R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]methyl-hydroxyphosphoryl] phosphate |
InChI: | InChI=1S/C11H18N5O12P3.2Li/c12-9-6-10(14-2-13-9)16(3-15-6)11-8(18)7(17)5(27-11)1-26-29(19,20)4-30(21,22)28-31(23,24)25;;/h2-3,5,7-8,11,17-18H,1,4H2,(H,19,20)(H,21,22)(H2,12,13,14)(H2,23,24,25);;/q;2*+1/p-2/t5-,7+,8?,11-;;/m1../s1 |
InChIKey: | HCFGXDSDFWEJAW-AZQCHLGCSA-L |
Canonical Smiles: | [Li+].[Li+].C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(CP(=O)(O)OP(=O)([O-])[O-])O)O)O)N |
Isomeric Smiles: | [Li+].[Li+].C1=NC(=C2C(=N1)N(C=N2)[C@H]3C([C@H]([C@H](O3)COP(=O)(CP(=O)(O)OP(=O)([O-])[O-])O)O)O)N |
Molecular Weight: | 517.1 |
Molecular Formula: | C11H16Li2N5O12P3 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
alpha,beta-Methylene adenosine 5'-triphosphate dilithium
Molecular Weight: | 517.1 |
Molecular Formula: | C11H16Li2N5O12P3 |
Hydrogen Bond Donor Count: | 5 |
Hydrogen Bond Acceptor Count: | 16 |
Rotatable Bond Count: | 7 |
Heavy Atom Count: | 33 |
Complexity: | 789 |
Synonyms
alpha,beta-Methylene adenosine 5'-triphosphate dilithium
| alpha,beta-Methylene adenosine 5'-triphosphate dilithium | alpha,beta-Methylene adenosine 5'-triphosphate dilithium |
|---|---|
"alpha,beta-Methylene adenosine 5-triphosphate dilithium |
HMS3262G20 |
CCG-222063 |
LP00759 |
EU-0100759 |
alpha,beta-Methylene ATP, AMP-CPP dilithium |
M 6517 |
Experimental Data
alpha,beta-Methylene adenosine 5'-triphosphate dilithium
| 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 | 4.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
alpha,beta-Methylene adenosine 5'-triphosphate dilithium
Statistics Data
alpha,beta-Methylene adenosine 5'-triphosphate dilithium
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 4.000000000000000 | 1 | 1 |
Statistics Data Visualization
alpha,beta-Methylene adenosine 5'-triphosphate dilithium
