Glycoside
GD004019
Name:
NoneFormula:
C24H34O9N4Smiles:
COc1ccc(CN(C)C[C@H](O[C@@H]2O[C@H](CN)[C@H](O)[C@H]2O)[C@@H]2C[C@H](O)[C@H](n3ccc(=O)[nH]c3=O)O2)cc1Aglycone:
COc1ccc(CN(C)CC(O)C2CC(O)C(n3ccc(=O)[nH]c3=O)O2)cc1Sugarmoiety:
NCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.58 |
| AlogP: | -1.88 | Num_rotatable_bonds: | 10 |
| MolWt: | 522.56 | Num_heavy_atoms: | 37 |
| TPSA: | 181.73 | NumAromaticRings: | 2 |
Unique Aglycone
AD03570
Formula: C19H25O6N3
Smiles:
COc1ccc(CN(C)CC(O)C2CC(O)C(n3ccc(=O)[nH]c3=O)O2)cc1| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | -0.31 | Num_rotatable_bonds: | 7 |
| MolWt: | 391.42 | Num_heavy_atoms: | 28 |
| TPSA: | 117.02 | NumAromaticRings: | 2 |
