Glycoside
GD085170
Name:
NoneFormula:
C19H24O8N2Smiles:
CCOC(=O)CCCc1ccc(C#N)cc1NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
CCOC(=O)CCCc1ccc(C#N)cc1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 11 |
| MolWt: | 408.41 | Num_heavy_atoms: | 29 |
| TPSA: | 177.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD38098
Formula: C13H16O2N2
Smiles:
CCOC(=O)CCCc1ccc(C#N)cc1N| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.38 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 232.28 | Num_heavy_atoms: | 17 |
| TPSA: | 76.11 | NumAromaticRings: | 1 |
