Glycoside
GD092549
Name:
NoneFormula:
C21H21O10NSmiles:
Cc1c(Nc2ccccc2C(=O)O[C@@H]2O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]2O)cccc1C(=O)OAglycone:
Cc1c(Nc2ccccc2C(=O)O)cccc1C(=O)OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.29 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 6 |
| MolWt: | 447.4 | Num_heavy_atoms: | 32 |
| TPSA: | 182.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD40344
Formula: C15H13O4N
Smiles:
Cc1c(Nc2ccccc2C(=O)O)cccc1C(=O)O| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 3.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 271.27 | Num_heavy_atoms: | 20 |
| TPSA: | 86.63 | NumAromaticRings: | 2 |
