Base information
| Cat. No. | |
| CAS No. | 860790-38-1 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C112H161N29O28 |
| Molecular Weight | 2361.65 |
| Exact Mass | 2360.21 |
| XLogP3 | 2.0047 |
| Mr | 621.975 |
| PSA | 889.84 |
| Sequence | - |
| Atom number | 330 |
| Bond number | 338 |
| Ring number | 9 |
| Rotor number | 87 |
| Residues number | 0 |
| Canonical smiles | NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CCCNC(=N)N)Cc1ccccc1)CO)Cc1ccccc1)CCC(=O)N)CC(C)C)CC(C)C)Cc1ccc(cc1)O)C)CO)CC(=O)N)CC(C)C)[C@H](O)C)Cc1c[nH]c2c1cccc2 |