Base information
| Cat. No. | |
| CAS No. | 2041283-06-9 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C114H152N2O2S14 |
| Molecular Weight | 2031.35 |
| Exact Mass | 2028.79 |
| XLogP3 | 41.6374 |
| Mr | 632.6 |
| PSA | 437.8 |
| Sequence | - |
| Atom number | 284 |
| Bond number | 296 |
| Ring number | 13 |
| Rotor number | 62 |
| Residues number | 0 |
| Canonical smiles | CCCCCCc1cc(sc1CC(CCCC)CC)c1c2cc(sc2c(c2c1sc(c2)c1sc(c(c1)CCCCCC)c1sc(c(c1)CCCCCC)c1ccc(s1)C=C1SC(=S)N(C1=O)CCCCCC)c1sc(c(c1)CCCCCC)CC(CCCC)CC)c1sc(c(c1)CCCCCC)c1sc(c(c1)CCCCCC)c1ccc(s1)C=C1SC(=S)N(C1=O)CCCCCC |
