Nitrate
PubChem CID: 943
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| Compound Synonyms | nitrate, NITRATE ION, 14797-55-8, Nitrates, Nitrate(1-), NO3-, trioxonitrate(V), trioxonitrate(1-), NITRATO, trioxidonitrate(1-), Nitrate (No3-), NITRATE ANION, UNII-T93E9Y2844, UN3218, T93E9Y2844, NITRATE ION (NO3-), CHEMBL186200, NO3, DTXSID5024217, NITRIC ACID, ION(1-), CHEBI:17632, Nitrate (6CI,7CI,8CI,9CI), NO3(-), Nitrate as N @ 1000 microg/mL in H2O, Nitrate as N @ 10000 microg/mL in H2O, Nitrate(1-), Nitrato, Nitric acid, ion(1-), Nitrate(6CI,7CI,8CI,9CI), NO3?, (NO3)(-), [NO3](-), Nitrate Standard: NO3- @ 1000 microg/mL in H2O, Nitrate Standard: NO3- @ 10000 microg/mL in H2O, nitrooxidane, trioxidonitrate, trioxonitrate, ISOSORBIDE DINITRATE, DILUTED IMPURITY A (EP IMPURITY), ISOSORBIDE DINITRATE, DILUTED IMPURITY A [EP IMPURITY], ISOSORBIDE MONONITRATE, DILUTED IMPURITY A (EP IMPURITY), ISOSORBIDE MONONITRATE, DILUTED IMPURITY A [EP IMPURITY], Nitrate Standard, MFCD00144920, INORGANIC NITRATES, 732 - Meat Based Sample, Nitrates, inorganic, n.o.s., DTXCID904217, Fresh water-Nitrate, low level, Nitrate Anion Standard Solution, Fresh water-Nitrate, high level, BDBM26988, AKOS015904030, 65 -Nitrate & Nitrite in milk powder, DB14049, N511, Nitrate standard solution (100 ppm NO3), 787 - Nitrate analysis of vegetable leaves, NS00114192, 798 - Nitrate in infant vegetable food puree, Q182168, Nitrates, inorganic, n.o.s. [UN1447] [Oxidizer], 718 - Nitrate and nitrite analysis of fish and fish products |
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| Topological Polar Surface Area | 62.9 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 4.0 |
| Description | The nitrate ion is a polyatomic ion. Nitrates are mainly produced for use as fertilizers in agriculture because of their high solubility and biodegradability. The main nitrates are ammonium, sodium, potassium, and calcium salts. Several million kilograms are produced annually for this purpose. [Wikipedia]. Nitrate is found in many foods, some of which are canola, peach, spelt, and loquat. |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 18.8 |
| Database Name | fooddb_chem_all;hmdb_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | nitrate |
| Nih Violation | False |
| Class | Non-metal oxoanionic compounds |
| Xlogp | -1.4 |
| Superclass | Homogeneous non-metal compounds |
| Is Pains | False |
| Subclass | Non-metal nitrates |
| Molecular Formula | NO3- |
| Inchi Key | NHNBFGGVMKEFGY-UHFFFAOYSA-N |
| Rotatable Bond Count | 0.0 |
| State | Solid |
| Synonyms | [NO3](-), Econazole nitrate, Femstat 3, Ganite, Gynazole-1, Isordil, Isosorbide dinitrate, Nitrate ion, Nitrate(1-), Nitrates, inorganic, n.o.s. [UN1447] [Oxidizer], Nitric acid, NITRic acid ion, Nitric acid(1-), NO3(-), Sorbitrate, Trioxidonitrate, Trioxidonitrate(1-), Trioxonitrate, Trioxonitrate(1-), NITRATE ion, NO3, Nitrates |
| Substituent Name | Non-metal nitrate, Inorganic oxide, Inorganic salt, Inorganic cation, Acyclic compound |
| Compound Name | Nitrate |
| Kingdom | Inorganic compounds |
| Exact Mass | 61.9878 |
| Formal Charge | -1.0 |
| Brenk Violation | True |
| Monoisotopic Mass | 61.9878 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 62.005 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Inchi | InChI=1S/NO3/c2-1(3)4/q-1 |
| Smiles | [N+](=O)([O-])[O-] |
| Defined Bond Stereocenter Count | 0.0 |
| Taxonomy Direct Parent | Non-metal nitrates |
- 1. Outgoing r'ship
FOUND_INto/from Ananas Comosus (Plant) Rel Props:Source_db:fooddb_chem_all