Showing Metabocard for sinapoyl (S)-malate (BASm0002685)
| Common Name | Sinapoyl (s)-malate |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C15H14O9 |
| Average Mass | 338.06490 |
| Monoisotopic Mass | Not Available |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | COc1cc(/C=C/C(=O)[O-])cc(OC)c1OC(=O)[C@@H](O)CC(=O)[O-] |
| InChI Identifier | InChI=1S/C15H16O9/c1-22-10-5-8(3-4-12(17)18)6-11(23-2)14(10)24-15(21)9(16)7-13(19)20/h3-6,9,16H,7H2,1-2H3,(H,17,18)(H,19,20)/p-2 |
| InChI Key | SVOZVFTXNDIEBH-UHFFFAOYSA-L |
| CHEBI ID | CHEBI:57426 |
| 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 | Not Available |
| Polarizability | Not Available |