Base information
| Cat. No. | |
| CAS No. | 5793-94-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C48H86CaO12 |
| Molecular Weight | 895.267 |
| Exact Mass | 894.575 |
| XLogP3 | 9.7224 |
| Mr | 239.763 |
| PSA | 185.46 |
| Sequence | - |
| Atom number | 147 |
| Bond number | 144 |
| Ring number | 0 |
| Rotor number | 44 |
| Residues number | 0 |
| Canonical smiles | CCCCCCCCCCCCCCCCCC(=O)OC(C(=O)OC(C(=O)[O-])C)C.CCCCCCCCCCCCCCCCCC(=O)OC(C(=O)OC(C(=O)[O-])C)C.[Ca+2] |
