Glycoside
GD009066
Name:
Quinofuracin EFormula:
C24H22O12Smiles:
O=C1c2cc(O[C@@H]3O[C@H]([C@H](O)CO)[C@H](O)[C@H]3O)cc(O)c2C(=O)c2c1cc1c(c2O)[C@@H]2CCO[C@H]2O1Aglycone:
O=C1c2cc(O)cc(O)c2C(=O)c2c1cc1c(c2O)C2CCOC2O1Sugarmoiety:
OCC(O)C1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | -0.73 | Num_rotatable_bonds: | 4 |
| MolWt: | 502.43 | Num_heavy_atoms: | 36 |
| TPSA: | 192.44 | NumAromaticRings: | 2 |
Unique Aglycone
AD07154
Formula: C18H12O7
Smiles:
O=C1c2cc(O)cc(O)c2C(=O)c2c1cc1c(c2O)C2CCOC2O1| HBA: | 7 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 0 |
| MolWt: | 340.29 | Num_heavy_atoms: | 25 |
| TPSA: | 113.29 | NumAromaticRings: | 2 |
