Glycoside
GD066095
Name:
NoneFormula:
C15H20O8N2Smiles:
CCOC(=O)c1cccc(CNC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)n1Aglycone:
CCOC(=O)c1cccc(CN)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -2.48 | Num_rotatable_bonds: | 9 |
| MolWt: | 356.33 | Num_heavy_atoms: | 25 |
| TPSA: | 166.28 | NumAromaticRings: | 1 |
Unique Aglycone
AD31730
Formula: C9H12O2N2
Smiles:
CCOC(=O)c1cccc(CN)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 3 |
| MolWt: | 180.21 | Num_heavy_atoms: | 13 |
| TPSA: | 65.21 | NumAromaticRings: | 1 |
