Glycoside
GD088209
Name:
NoneFormula:
C19H26O9N2Smiles:
COc1ccc(CN2C[C@@H](NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)CC2=O)c(OC)c1Aglycone:
COc1ccc(CN2CC(N)CC2=O)c(OC)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -2.43 | Num_rotatable_bonds: | 10 |
| MolWt: | 426.42 | Num_heavy_atoms: | 30 |
| TPSA: | 165.86 | NumAromaticRings: | 1 |
Unique Aglycone
AD38616
Formula: C13H18O3N2
Smiles:
COc1ccc(CN2CC(N)CC2=O)c(OC)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 4 |
| MolWt: | 250.3 | Num_heavy_atoms: | 18 |
| TPSA: | 64.79 | NumAromaticRings: | 1 |
