Showing Metabocard for (E)-1-(glycyl-L-cystein-S-yl)-2-(1H-indol-3-yl)acetohydroximate (BASm0008817)
| Common Name | (e)-1-(glycyl-l-cystein-s-yl)-2-(1h-indol-3-yl)acetohydroximate |
|---|---|
| Description | Not Available |
| Structure | |
| Molecular Formula | C15H18N4O4S |
| Average Mass | 350.39000 |
| Monoisotopic Mass | 350.10488 |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | [NH3+][C@@H](CS/C(Cc1c[nH]c2ccccc12)=N/O)C(=O)NCC(=O)[O-] |
| InChI Identifier | InChI=1S/C15H18N4O4S/c16-11(15(22)18-7-14(20)21)8-24-13(19-23)5-9-6-17-12-4-2-1-3-10(9)12/h1-4,6,11,17,23H,5,7-8,16H2,(H,18,22)(H,20,21)/b19-13- |
| InChI Key | PQEHILHGDWJAOT-UYRXBGFRSA-N |
| CHEBI ID | CHEBI:136831 |
| MiMeDB ID | MMDBc0053354 |
| 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 |