Glycoside
GD067478
Name:
NoneFormula:
C15H20O8N2Smiles:
C#CCN1C(=O)COCC12CN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)C2Aglycone:
C#CCN1C(=O)COCC12CNC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -4.3 | Num_rotatable_bonds: | 6 |
| MolWt: | 356.33 | Num_heavy_atoms: | 25 |
| TPSA: | 147.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD32164
Formula: C9H12O2N2
Smiles:
C#CCN1C(=O)COCC12CNC2| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | -1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 180.21 | Num_heavy_atoms: | 13 |
| TPSA: | 41.57 | NumAromaticRings: | 0 |
