Showing Metabocard for (7R)-7-(4-carboxybutanamido)cephalosporanate (BASm0003634)
| Common Name | (7r)-7-(4-carboxybutanamido)cephalosporanate |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C15H18N2O8S |
| Average Mass | 386.37700 |
| Monoisotopic Mass | 386.07839 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | CC(=O)OCC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)CCCC(=O)[O-])[C@H]2SC1 |
| InChI Identifier | InChI=1S/C15H18N2O8S/c1-7(18)25-5-8-6-26-14-11(13(22)17(14)12(8)15(23)24)16-9(19)3-2-4-10(20)21/h11,14H,2-6H2,1H3,(H,16,19)(H,20,21)(H,23,24)/t11-,14-/m1/s1 |
| InChI Key | IXUSDMGLUJZNFO-BXUZGUMPSA-N |
| CHEBI ID | CHEBI:58693 |
| MiMeDB ID | MMDBc0054076 |
| 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 |