Glycoside
GD058566
Name:
NoneFormula:
C16H15O6N3Smiles:
N#Cc1ccc(NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)c2cccnc12Aglycone:
N#Cc1ccc(N)c2cccnc12Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.25 |
| AlogP: | -1.31 | Num_rotatable_bonds: | 6 |
| MolWt: | 345.31 | Num_heavy_atoms: | 25 |
| TPSA: | 163.77 | NumAromaticRings: | 2 |
Unique Aglycone
AD29259
Formula: C10H7N3
Smiles:
N#Cc1ccc(N)c2cccnc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.69 | Num_rotatable_bonds: | 0 |
| MolWt: | 169.19 | Num_heavy_atoms: | 13 |
| TPSA: | 62.7 | NumAromaticRings: | 2 |
