Base information
| Cat. No. | |
| CAS No. | 112078-08-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C88H90N2O8 |
| Molecular Weight | 1303.66 |
| Exact Mass | 1302.67 |
| XLogP3 | 24.3212 |
| Mr | 410.15 |
| PSA | 111.68 |
| Sequence | - |
| Atom number | 188 |
| Bond number | 200 |
| Ring number | 13 |
| Rotor number | 18 |
| Residues number | 0 |
| Canonical smiles | O=C1N(c2c(cccc2C(C)C)C(C)C)C(=O)c2c3c1cc(Oc1ccc(cc1)C(C)(C)C)c1c3c(c(c2)Oc2ccc(cc2)C(C)(C)C)c2c3c1c(Oc1ccc(cc1)C(C)(C)C)cc1c3c(cc2Oc2ccc(cc2)C(C)(C)C)C(=O)N(C1=O)c1c(cccc1C(C)C)C(C)C |
