Glycoside
GD102179
Name:
NoneFormula:
C23H27O7N5Smiles:
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ncnc2c1ccn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCOC(=O)C(Cc1ccccc1)NC(=O)Nc1ncnc2c1C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 8 |
| MolWt: | 485.5 | Num_heavy_atoms: | 35 |
| TPSA: | 168.06 | NumAromaticRings: | 3 |
Unique Aglycone
AD43240
Formula: C18H18O3N5
Smiles:
CCOC(=O)C(Cc1ccccc1)NC(=O)Nc1ncnc2c1C=C[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 6 |
| MolWt: | 352.37 | Num_heavy_atoms: | 26 |
| TPSA: | 107.31 | NumAromaticRings: | 2 |
