Compound Summary
93882-12-3
Compound Information
93882-12-3
Compound Name: | 93882-12-3 |
Compound CID: | 23672705 |
Synonyms: | 93882-12-3 8-Cpt-camp 8-CPT-Cyclic AMP (sodium salt) 8-(4-Chlorophenylthio)-cAMP sodium sodium;(4aR,6R,7R,7aS)-6-6-amino-8-(4-chlorophenyl)sulfanylpurin-9-yl-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo3,2-d1,3,2dioxaphosphinin-7-ol More... |
Iupac Name: | sodium;(4aR,6R,7R,7aS)-6-[6-amino-8-(4-chlorophenyl)sulfanylpurin-9-yl]-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol |
InChI: | InChI=1S/C16H15ClN5O6PS.Na/c17-7-1-3-8(4-2-7)30-16-21-10-13(18)19-6-20-14(10)22(16)15-11(23)12-9(27-15)5-26-29(24,25)28-12;/h1-4,6,9,11-12,15,23H,5H2,(H,24,25)(H2,18,19,20);/q;+1/p-1/t9-,11-,12-,15-;/m1./s1 |
InChIKey: | YIJFVHMIFGLKQL-DNBRLMRSSA-M |
Canonical Smiles: | C1C2C(C(C(O2)N3C4=NC=NC(=C4N=C3SC5=CC=C(C=C5)Cl)N)O)OP(=O)(O1)[O-].[Na+] |
Isomeric Smiles: | C1[C@@H]2[C@H]([C@H]([C@@H](O2)N3C4=NC=NC(=C4N=C3SC5=CC=C(C=C5)Cl)N)O)OP(=O)(O1)[O-].[Na+] |
Molecular Weight: | 493.8 |
Molecular Formula: | C16H14ClN5NaO6PS |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
93882-12-3
Molecular Weight: | 493.8 |
Molecular Formula: | C16H14ClN5NaO6PS |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 11 |
Rotatable Bond Count: | 3 |
Heavy Atom Count: | 31 |
Complexity: | 699 |
Synonyms
93882-12-3
| 93882-12-3 | 93882-12-3 |
|---|---|
93882-12-3 |
8-Cpt-camp |
8-CPT-Cyclic AMP (sodium salt) |
8-(4-Chlorophenylthio)-cAMP sodium |
sodium;(4aR,6R,7R,7aS)-6-6-amino-8-(4-chlorophenyl)sulfanylpurin-9-yl-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo3,2-d1,3,2dioxaphosphinin-7-ol |
pCPT-cAMP |
MLS002153200 |
8-(4-Chlorophenylthio)adenosine 3,5-cyclic monophosphate sodium salt |
SMR000326853 |
EINECS 299-413-9 |
8-(4-Chlorophenylthio)adenosine-3,5-cyclic monophosphate |
MLS000859994 |
CHEMBL1257074 |
HMS2233E23 |
MFCD00057683 |
Adenosine, 8-((4-chlorophenyl)thio)-, cyclic 3,5-(hydrogen phosphate), monosodium salt" |
8-(4-Chlorophenyl)thioadenosine 3,5-phosphoric acid sodium salt" |
Adenosine,8-(4-chlorophenyl)thio-,cyclic 3,5-(hydrogen phosphate),monosodium salt(9ci)" |
8-(4-Chlorophenylthio)adenosine 3,5-cyclic monophosphate sodium salt, >=97.0% (HPLC), powder" |
Adenosine 3,5-cyclic Monophosphate, 8-(4-Chlorophenylthio)-, Sodium Salt - CAS 93882-12-3" |
Experimental Data
93882-12-3
| 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 | 5.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
93882-12-3
Statistics Data
93882-12-3
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 5.000000000000000 | 1 | 1 |
Statistics Data Visualization
93882-12-3
