Glycoside
GD090872
Name:
NoneFormula:
C21H31O9NSmiles:
CCOC(=O)c1ccc(CC(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)cc1OCCAglycone:
CCOC(=O)c1ccc(CC(=O)NCCO)cc1OCCSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 10 |
| MolWt: | 441.48 | Num_heavy_atoms: | 31 |
| TPSA: | 143.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD39563
Formula: C15H21O5N
Smiles:
CCOC(=O)c1ccc(CC(=O)NCCO)cc1OCC| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.47 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 8 |
| MolWt: | 295.34 | Num_heavy_atoms: | 21 |
| TPSA: | 84.86 | NumAromaticRings: | 1 |
