Base information
| Cat. No. | |
| CAS No. | 125-67-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H21KO6 |
| Molecular Weight | 384.465 |
| Exact Mass | 384.098 |
| XLogP3 | -0.3076 |
| Mr | 84.9231 |
| PSA | 106.89 |
| Sequence | - |
| Atom number | 47 |
| Bond number | 50 |
| Ring number | 5 |
| Rotor number | 1 |
| Residues number | 0 |
| Canonical smiles | [O-]C(=O)[C@H]1[C@H]2[C@]3([C@H]4[C@]51CC(=C)[C@](C5)(O)CC4)C=C[C@@H]([C@@]2(C)C(=O)O3)O.[K+] |
