Base information
| Cat. No. | |
| CAS No. | 81489-69-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C37H44O13 |
| Molecular Weight | 696.737 |
| Exact Mass | 696.278 |
| XLogP3 | 3.0497 |
| Mr | 175.434 |
| PSA | 178.03 |
| Sequence | - |
| Atom number | 94 |
| Bond number | 98 |
| Ring number | 5 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | CC(=O)O[C@H]1C[C@H](OC(=O)/C=C/c2ccccc2)C(=C)[C@@H]2[C@]1(C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@]1([C@@]3([C@H]([C@H]2OC(=O)C)CC(=O)[C@@]1(C)OC3)C)O |
