Glycoside
GD031405
Name:
NoneFormula:
C32H45O7NSmiles:
Cc1cc(C=CC(C)(C)C(=O)NC(C)(C)CO)ccc1Cc1cc([C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(C)cc1CAglycone:
Cc1ccc(Cc2ccc(C=CC(C)(C)C(=O)NC(C)(C)CO)cc2C)c(C)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 9 |
| MolWt: | 555.71 | Num_heavy_atoms: | 40 |
| TPSA: | 139.48 | NumAromaticRings: | 2 |
Unique Aglycone
AD20240
Formula: C26H35O2N
Smiles:
Cc1ccc(Cc2ccc(C=CC(C)(C)C(=O)NC(C)(C)CO)cc2C)c(C)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.42 |
| AlogP: | 5.13 | Num_rotatable_bonds: | 7 |
| MolWt: | 393.57 | Num_heavy_atoms: | 29 |
| TPSA: | 49.33 | NumAromaticRings: | 2 |
