Glycoside
GD031403
Name:
NoneFormula:
C34H49O7NSmiles:
Cc1cc(C)c([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc(C=CC(C)(C)C(=O)NC(C)(C)CO)cc1C(C)CAglycone:
Cc1ccc(Cc2ccc(C=CC(C)(C)C(=O)NC(C)(C)CO)cc2C(C)C)c(C)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | 3.46 | Num_rotatable_bonds: | 10 |
| MolWt: | 583.77 | Num_heavy_atoms: | 42 |
| TPSA: | 139.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD20238
Formula: C28H39O2N
Smiles:
Cc1ccc(Cc2ccc(C=CC(C)(C)C(=O)NC(C)(C)CO)cc2C(C)C)c(C)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 5.94 | Num_rotatable_bonds: | 8 |
| MolWt: | 421.63 | Num_heavy_atoms: | 31 |
| TPSA: | 49.33 | NumAromaticRings: | 2 |
