PDB CCD ID: | TNF |
Number of entries in BioLiP: | 15 |
Chemical formula: | C6 H3 N3 O7 |
InChI: | InChI=1S/C6H3N3O7/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-2,10H |
InChIKey: | OXNIZHLAWKMVMX-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.5.0 | c1c(cc(c(c1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-] | CACTVS 3.341 | Oc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O | ACDLabs 10.04 | O=[N+]([O-])c1cc(cc([N+]([O-])=O)c1O)[N+]([O-])=O |
|
Name: | PICRIC ACID; 2,4,6-TRINITROPHENOL |
ChEMBL: | CHEMBL108541 |
DrugBank: | DB03651 |
ZINC: | ZINC000001883067 |