Base information
| Cat. No. | |
| CAS No. | 149370-53-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C81H132N2O30 |
| Molecular Weight | 1613.91 |
| Exact Mass | 1612.89 |
| XLogP3 | 5.1447 |
| Mr | 410.814 |
| PSA | 412.1 |
| Sequence | - |
| Atom number | 245 |
| Bond number | 249 |
| Ring number | 6 |
| Rotor number | 27 |
| Residues number | 0 |
| Canonical smiles | O=CC[C@H]1C[C@@H](C)[C@@H](O)/C=C/C=C/C[C@H](OC(=O)C[C@H]([C@@H]([C@H]1O[C@@H]1O[C@H](C)[C@H]([C@@H]([C@H]1O)N(C)C)O[C@@H]1O[C@@H](C)[C@@H]([C@](C1)(C)O)OC(=O)CC)OC)OC(=O)CC)C.O=CC[C@H]1C[C@@H](C)[C@@H](O)/C=C/C=C/C[C@H](OC(=O)C[C@H]([C@@H]([C@H]1O[C@@H]1O[C@H](C)[C@H]([C@@H]([C@H]1O)N(C)C)O[C@@H]1O[C@@H](C)[C@@H]([C@](C1)(C)O)OC(=O)CC)OC)OC(=O)C)C |
