Glycoside
GD055059
Name:
NoneFormula:
C14H21O7N3Smiles:
O=C(C(=O)N1Cc2ccnn2CC[C@@H]1CO)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
OCC1CCn2nccc2CN1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.64 |
| AlogP: | -3.38 | Num_rotatable_bonds: | 6 |
| MolWt: | 343.34 | Num_heavy_atoms: | 24 |
| TPSA: | 156.35 | NumAromaticRings: | 1 |
Unique Aglycone
AD27939
Formula: C8H13ON3
Smiles:
OCC1CCn2nccc2CN1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.62 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 1 |
| MolWt: | 167.21 | Num_heavy_atoms: | 12 |
| TPSA: | 50.08 | NumAromaticRings: | 1 |
