Glycoside
GD097761
Name:
NoneFormula:
C23H31O9NSmiles:
COc1cc2c(cc1OC)C(=O)[C@H](CC1CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)CC1)C2Aglycone:
COc1cc2c(cc1OC)C(=O)C(CC1CCNCC1)C2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.61 |
| AlogP: | -0.67 | Num_rotatable_bonds: | 9 |
| MolWt: | 465.5 | Num_heavy_atoms: | 33 |
| TPSA: | 153.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD41609
Formula: C17H23O3N
Smiles:
COc1cc2c(cc1OC)C(=O)C(CC1CCNCC1)C2| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.59 |
| AlogP: | 2.45 | Num_rotatable_bonds: | 4 |
| MolWt: | 289.38 | Num_heavy_atoms: | 21 |
| TPSA: | 47.56 | NumAromaticRings: | 1 |
