Compound Summary
Compound Information
FUREGRELATE SODIUM
Compound Name: | FUREGRELATE SODIUM |
Compound CID: | 23663954 |
Synonyms: | FUREGRELATE SODIUM 85666-17-7 U-63557A Furegrelate (sodium) UNII-4F11B27M90 More... |
Iupac Name: | sodium;5-(pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate |
InChI: | InChI=1S/C15H11NO3.Na/c17-15(18)14-8-12-7-10(3-4-13(12)19-14)6-11-2-1-5-16-9-11;/h1-5,7-9H,6H2,(H,17,18);/q;+1/p-1 |
InChIKey: | XBTIPIZROJAKOJ-UHFFFAOYSA-M |
Canonical Smiles: | C1=CC(=CN=C1)CC2=CC3=C(C=C2)OC(=C3)C(=O)[O-].[Na+] |
Isomeric Smiles: | C1=CC(=CN=C1)CC2=CC3=C(C=C2)OC(=C3)C(=O)[O-].[Na+] |
Molecular Weight: | 275.23 |
Molecular Formula: | C15H10NNaO3 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
FUREGRELATE SODIUM
Molecular Weight: | 275.23 |
Molecular Formula: | C15H10NNaO3 |
Hydrogen Bond Donor Count: | 0 |
Hydrogen Bond Acceptor Count: | 4 |
Rotatable Bond Count: | 3 |
Heavy Atom Count: | 20 |
Complexity: | 339 |
Synonyms
FUREGRELATE SODIUM
| FUREGRELATE SODIUM | FUREGRELATE SODIUM |
|---|---|
FUREGRELATE SODIUM |
85666-17-7 |
U-63557A |
Furegrelate (sodium) |
UNII-4F11B27M90 |
Furegrelate sodium salt |
Furegrelate Sodium (U-63557A) |
sodium;5-(pyridin-3-ylmethyl)-1-benzofuran-2-carboxylate |
4F11B27M90 |
NCGC00016149-03 |
U 63557A |
5-(3-Pyridinylmethyl)benzofuran-2-carboxylate sodium |
Furegrelate sdium |
Sodium 5-(3-pyridinylmethyl)-2-benzofurancarboxylate |
Lopac-F-3764 |
DSSTox_CID_25226 |
DSSTox_RID_80763 |
DSSTox_GSID_45226 |
C15H10NO3.Na |
CHEMBL36028 |
SCHEMBL635010 |
SPECTRUM1501195 |
DTXSID8045226 |
GTPL11378 |
HMS500M17 |
HMS1921P11 |
HMS3261H11 |
HMS3649O07 |
2-Benzofurancarboxylic acid, 5-(3-pyridinylmethyl)-, sodium salt |
Tox21_110310 |
Tox21_500515 |
1774AH |
CCG-39186 |
MFCD00058448 |
HY-106080A |
LP00515 |
U63557A |
NCGC00016149-01 |
NCGC00016149-02 |
NCGC00016149-04 |
NCGC00093910-01 |
NCGC00093910-02 |
NCGC00093910-03 |
NCGC00261200-01 |
CAS-87463-91-0 |
CS-0024809 |
EU-0100515 |
FT-0727090 |
F 3764 |
5-(3-Pyridinylmethyl)benzofurancarboxylic acid sodium |
Q27259502 |
sodium 5-(pyridin-3-ylmethyl)benzofuran-2-carboxylate |
Experimental Data
FUREGRELATE SODIUM
| Species | Dosage | Unit | CG Lifespan(AVG/MED days) | TG Lifespan(AVG/MED days) | Lifespan Change(AVG/MED%) | CG Lifespan(MAX days) | TG Lifespan(MAX days) | Lifespan Change(MAX%) | Significant | Strain | Gender | PubMed | Active Label |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33 | umol/L | -2 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
FUREGRELATE SODIUM
Statistics Data
FUREGRELATE SODIUM
| Species | Lifespan Change(AVG/MED%) | Lifespan Change(MAX%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | -2 | 1 | 1 |
Statistics Data Visualization
FUREGRELATE SODIUM
