Glycoside
GD060124
Name:
NoneFormula:
C17H21O5N3Smiles:
Cc1ccccc1-c1ccc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
Cc1ccccc1-c1ccc(N)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -0.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 347.37 | Num_heavy_atoms: | 25 |
| TPSA: | 127.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD29711
Formula: C11H11N3
Smiles:
Cc1ccccc1-c1ccc(N)nn1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 2.03 | Num_rotatable_bonds: | 1 |
| MolWt: | 185.23 | Num_heavy_atoms: | 14 |
| TPSA: | 51.8 | NumAromaticRings: | 2 |
