3,4,5-Trihydroxybenzoic acid; Anilide
AlkaPlorer ID: AK039919
Synonym: 3,4,5-Trihydroxy-N-phenylbenzamide, 3,4,5-Trihydroxybenzanilide, Gallanilide
IUPAC Name: 3,4,5-trihydroxy-N-phenylbenzamide
Structure
SMILES: O=C(NC1=CC=CC=C1)C1=CC(O)=C(O)C(O)=C1
InChI: InChI=1S/C13H11NO4/c15-10-6-8(7-11(16)12(10)17)13(18)14-9-4-2-1-3-5-9/h1-7,15-17H,(H,14,18)
InChIKey: HLVGXGQCLASQJU-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| Tetramorium sp. | Tetramorium | Formicidae | Hymenoptera | Insecta | Arthropoda | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 245.234
TPSA？: 89.79
MolLogP？: 2.0557
Number of H-Donors: 4
Number of H-Acceptors: 4
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|---|---|---|---|---|
| Bacillus subtilis | Bacillus subtilis | IZ | 0.0 | mm | 10.1016/j.bmcl.2012.01.112 |
| Bacillus subtilis | Bacillus subtilis | MIC | 25.0 | ug.mL-1 | 10.1016/j.bmcl.2012.01.112 |
| Escherichia coli | Escherichia coli | Activity | nan | None | 10.1016/j.bmcl.2012.01.112 |
| Homo sapiens | DNA topoisomerase I | IC50 | 100000.0 | nM | 10.1016/j.bmcl.2004.01.060 |
| Mus musculus | Peritoneal macrophage | Inhibition | nan | % | 10.1016/j.bmc.2019.115049 |