Compound Summary
benzoate
Compound Information
benzoate
Compound Name: | benzoate |
Compound CID: | 242 |
Synonyms: | benzoate 766-76-7 benzoate anion Benzoic acid, ion(1-) Phenylformate More... |
Iupac Name: | benzoate |
InChI: | InChI=1S/C7H6O2/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H,8,9)/p-1 |
InChIKey: | WPYMKLBDIGXBTP-UHFFFAOYSA-M |
Canonical Smiles: | C1=CC=C(C=C1)C(=O)[O-] |
Isomeric Smiles: | C1=CC=C(C=C1)C(=O)[O-] |
Molecular Weight: | 121.11 |
Molecular Formula: | C7H5O2- |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
benzoate
Molecular Weight: | 121.11 |
Molecular Formula: | C7H5O2- |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 2 |
Rotatable Bond Count: | 0 |
Heavy Atom Count: | 9 |
Complexity: | 98 |
Synonyms
benzoate
| benzoate | benzoate |
|---|---|
benzoate |
766-76-7 |
benzoate anion |
Benzoic acid, ion(1-) |
Phenylformate |
Benzeneformate |
Benzenemethanoate |
Phenylcarboxylate |
Benzenecarboxylate |
benzoic acid anion |
benzene-carboxylate |
Tennplas |
Oracyclic acid |
Retarded BA |
4-Carboxybenzenide |
Benzene formic acid |
Phenyl carboxylic acid |
GTPL4565 |
DTXSID4043771 |
BDBM36181 |
CHEBI:16150 |
STL483236 |
ZINC328578076 |
NCGC00247905-01 |
Q27075054 |
Experimental Data
benzoate
| 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 | 50.000000000000000 | umol/L | 15.190000000000000 | 17.350000000000000 | 14.000000000000000 | 21.000000000000000 | 23.000000000000000 | 0.100000000000000 | S | N2 | 35218907 | Active |
Experimental Data Visualization
benzoate
Statistics Data
benzoate
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 14.000000000000000 | 0.100000000000000 | 1 | 1 |
Statistics Data Visualization
benzoate
