Glycoside
GD028840
Name:
NoneFormula:
C22H25O6N3Smiles:
Cc1ccccc1CNC(=O)c1ccc2[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nc2c1Aglycone:
Cc1ccccc1CNC(=O)c1ccc2[nH]cnc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.36 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 5 |
| MolWt: | 427.46 | Num_heavy_atoms: | 31 |
| TPSA: | 147.93 | NumAromaticRings: | 3 |
Unique Aglycone
AD18802
Formula: C16H15ON3
Smiles:
Cc1ccccc1CNC(=O)c1ccc2[nH]cnc2c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 2.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 265.32 | Num_heavy_atoms: | 20 |
| TPSA: | 57.78 | NumAromaticRings: | 3 |
