Showing Metabocard for (1R,10aS)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylate (BASm0008177)
| Common Name | (1r,10as)-1,4,10,10a-tetrahydrophenazine-1,6-dicarboxylate |
|---|---|
| Description | A member of the class of phenazines that is 1,4,10,10a-tetrahydrophenazine substituted at positions 1 and 6 by carboxy groups (the 1R,10aS-diastereomer). |
| Structure | |
| Molecular Formula | C14H12N2O4 |
| Average Mass | 272.26000 |
| Monoisotopic Mass | 272.07971 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | O=C([O-])c1cccc2c1N=C1CC=C[C@@H](C(=O)[O-])[C@@H]1N2 |
| InChI Identifier | InChI=1S/C14H12N2O4/c17-13(18)7-3-1-5-9-11(7)16-10-6-2-4-8(14(19)20)12(10)15-9/h1-5,8,12,15H,6H2,(H,17,18)(H,19,20)/t8-,12+/m1/s1 |
| InChI Key | CUYPWOPOBAHCCE-PELKAZGASA-N |
| CHEBI ID | CHEBI:131973 |
| MiMeDB ID | MMDBc0032889 |
| State | Expected Solid |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | Not Available |
| Polarizability | Not Available |