Glycoside
GD025714
Name:
NoneFormula:
C25H38O11N4Smiles:
NCC1OC(OC2C(NC(=O)OCc3ccccc3)CC(N)C(O)C2OC2O[C@H](CO)[C@H](O)[C@H]2O)C2NC2C1OAglycone:
NCC1OC(OC2C(NC(=O)OCc3ccccc3)CC(N)C(O)C2O)C2NC2C1OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 11 | FractionCSP3: | 0.72 |
| AlogP: | -4.03 | Num_rotatable_bonds: | 9 |
| MolWt: | 570.6 | Num_heavy_atoms: | 40 |
| TPSA: | 250.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD17019
Formula: C20H30O7N4
Smiles:
NCC1OC(OC2C(NC(=O)OCc3ccccc3)CC(N)C(O)C2O)C2NC2C1O| HBA: | 11 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.65 |
| AlogP: | -2.5 | Num_rotatable_bonds: | 6 |
| MolWt: | 438.48 | Num_heavy_atoms: | 31 |
| TPSA: | 191.46 | NumAromaticRings: | 1 |
