Showing Metabocard for (E)-sinapoyltartronate (BASm0002880)
| Common Name | (e)-sinapoyltartronate |
|---|---|
| Description | Dicarboxylate anion of sinapoyltartronic acid. |
| Structure | |
| Molecular Formula | C14H12O9 |
| Average Mass | 324.23970 |
| Monoisotopic Mass | Not Available |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | COc1cc(/C=C/C(=O)OC(C(=O)[O-])C(=O)[O-])cc(OC)c1O |
| InChI Identifier | InChI=1S/C14H14O9/c1-21-8-5-7(6-9(22-2)11(8)16)3-4-10(15)23-12(13(17)18)14(19)20/h3-6,12,16H,1-2H3,(H,17,18)(H,19,20)/p-2/b4-3+ |
| InChI Key | BILXTXFCLYPNMR-ONEGZZNKSA-L |
| CHEBI ID | CHEBI:57680 |
| State | Not Available |
| 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 | -2 |
| Polarizability | Not Available |