Base information
| Cat. No. | |
| CAS No. | 176767-94-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C45H45N3O20S |
| Molecular Weight | 979.912 |
| Exact Mass | 979.232 |
| XLogP3 | 3.7039 |
| Mr | 238.982 |
| PSA | 306.68 |
| Sequence | - |
| Atom number | 114 |
| Bond number | 118 |
| Ring number | 5 |
| Rotor number | 32 |
| Residues number | 0 |
| Canonical smiles | CC(=O)OCOC(=O)CN(c1ccc(cc1OCCOc1cc2cc(c(=O)oc2cc1N(CC(=O)OCOC(=O)C)CC(=O)OCOC(=O)C)c1sc2c(n1)cccc2)C)CC(=O)OCOC(=O)C |
