Base information
| Cat. No. | |
| CAS No. | 2027551-44-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C76H46N4O20 |
| Molecular Weight | 1335.19 |
| Exact Mass | 1334.27 |
| XLogP3 | 11.621 |
| Mr | 365.208 |
| PSA | 391.62 |
| Sequence | - |
| Atom number | 146 |
| Bond number | 158 |
| Ring number | 13 |
| Rotor number | 20 |
| Residues number | 0 |
| Canonical smiles | OC(=O)c1cc(Oc2ccc(cc2)/C/2=C/3\C=CC(=N3)/C(=c\3/cc/c(=C(/C4=N/C(=C(\c5[nH]c2cc5)/c2ccc(cc2)Oc2cc(cc(c2)C(=O)O)C(=O)O)/C=C4)\c2ccc(cc2)Oc2cc(cc(c2)C(=O)O)C(=O)O)/[nH]3)/c2ccc(cc2)Oc2cc(cc(c2)C(=O)O)C(=O)O)cc(c1)C(=O)O |
