Glycoside
GD044936
Name:
NoneFormula:
C11H17O6N3Smiles:
N#C[C@@H]1CNCCN1C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
N#CC1CNCCN1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -4.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 287.27 | Num_heavy_atoms: | 20 |
| TPSA: | 154.12 | NumAromaticRings: | 0 |
Unique Aglycone
AD25140
Formula: C5H9N3
Smiles:
N#CC1CNCCN1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 0 |
| MolWt: | 111.15 | Num_heavy_atoms: | 8 |
| TPSA: | 47.85 | NumAromaticRings: | 0 |
