Base information
| Cat. No. | |
| CAS No. | 12627-35-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C37H44ClNO6 |
| Molecular Weight | 634.201 |
| Exact Mass | 633.286 |
| XLogP3 | 5.6617 |
| Mr | 171.848 |
| PSA | 107.47 |
| Sequence | - |
| Atom number | 89 |
| Bond number | 98 |
| Ring number | 10 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | CC(=C)[C@H]1O[C@H]2CC[C@]3([C@@]([C@]42[C@@H]([C@H]1O)O4)(O)CC[C@@H]1[C@]3(C)c2[nH]c3c4c2[C@H]1OC(C)(C)[C@@H]1[C@]2(c4c(c(c3)Cl)CC(=C)[C@H]2C1)O)C |
