ACONITIC ACID
| SMILES | O=C(O)/C=C(\CC(=O)O)C(=O)O |
| InChIKey | GTZCVFVGUGFEME-HNQUOIGGSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 174.0 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |