Drug Information| Drug ID: | NPD108 |
| Drug Name: | Ferric Pyrophosphate Citrate |
| Molecular Formula: | 3C6H8O7.4Fe.3H4O7P2 |
| Canonical SMILES: | OP(=O)(OP(=O)(O)O)O.OP(=O)(OP(=O)(O)O)O.[O-]P(=O)(OP(=O)(O)[O-])[O-].[O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.[O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.[O-]C(=O)C(CC(=O)[O-])(CC(=O)[O-])O.[Fe+3].[Fe+3].[Fe+3].[Fe+3] |
| Standard InCHI: | InChI=1S/3C6H8O7.4Fe.3H4O7P2/c3*7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;3*1-8(2,3)7-9(4,5)6/h3*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;;;3*(H2,1,2,3)(H2,4,5,6)/q;;;4*+3;;;/p-12 |
| Standard InCHIKey: | SXAWSYZURCZSDX-UHFFFAOYSA-B |
| Max Developmental Stage: | Approved |
| Max Developmental Stage Source: | ChEMBL |
Structural Similarity Between NPASS Natural Products and NPD108Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient 
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
Similar Natural Products High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7