Base information
| Cat. No. | |
| CAS No. | 851536-75-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C55H87NO14 |
| Molecular Weight | 986.278 |
| Exact Mass | 985.613 |
| XLogP3 | 7.1793 |
| Mr | 273.915 |
| PSA | 193.66 |
| Sequence | - |
| Atom number | 157 |
| Bond number | 160 |
| Ring number | 4 |
| Rotor number | 11 |
| Residues number | 0 |
| Canonical smiles | CCOCCO[C@@H]1CC[C@H](C[C@H]1OC)C[C@H]([C@@H]1CC(=O)[C@H](C)/C=C(\C)/[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)/C=C/C=C/C=C(/[C@H](C[C@H]2O[C@](C(=O)C(=O)N3[C@H](C(=O)O1)CCCC3)(O)[C@H](C)CC2)OC)\C)C |
